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CAS 129722-12-9 Aripiprazole molecular structure lightbox
CAS RN: 129722-12-9

Aripiprazole

Product Availability

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7 package records7 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260302 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250501 1ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250128 100g In stock Inquiry
Batchno.20260107 1g In stock Inquiry
Batchno.20251205 200mg In stock Inquiry
Batchno.20250303 25g In stock Inquiry
Batchno.20250602 5g In stock Inquiry
  • Product code: SSC-036582
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 129722-12-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Beijing Inquiry

129722-12-9 / 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one

Standard CAS: 129722-12-9 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
129722-12-9
Multi CAS
No
Molecular Formula
C23H27Cl2N3O2
Molecular Weight
448.400000
Exact Mass
447.148033
SMILES
C1CC(=O)NC2=C1C=CC(=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl
InChI
InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
InChIKey
CEUORZQYGODEFX-UHFFFAOYSA-N

Physical Properties

Melting Point
137-140
Boiling Point
139.0-139.5 °C
Physical Description
Solid
Appearance
Colorless, flake crystals from ethanol
State
Solid
Storage Conditions
Conditions for safe storage, including any incompatibilities: Keep container tightly closed in a dry and well-ventilated place. Containers which are opened must be carefully resealed and kept upright to prevent leakage. Storage class (TRGS 510): Flammable liquids

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
12
Fraction Csp3
0.43
Rotatable bonds
7
H-bond acceptors
4
H-bond donors
1
Molar refractivity
123.24
TPSA
44.81

LogP / Solubility

WLOGP
4.86
MLOGP
4.31
XLogP3
4.6
Consensus LogP
4.59
Log S (ESOL)
-5.52
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.75
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.45
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.01

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Acute Toxic Irritant Health Hazard Flammable Corrosive
Signal
Danger
GHS Hazard Statements
H301 (62.7%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (35.3%): Harmful if swallowed [Warning Acute toxicity, oral] H361 (15.7%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity] H413 (13.7%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] H226: Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement Codes
P203, P264, P270, P273, P280, P301+P316, P301+P317, P318, P321, P330, P405, and P501 P210, P233, P234, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P308+P316, P316, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P390, P403+P233, P403+P235, P405, P406, and P501

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