CAS RN: 1583244-06-7

2-([Bis(2-pyridinylmethyl)amino]ethylamino}benzenesulfonic acid hydrate sodium salt ZX1

Product Availability

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5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250126 100mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260608 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
Batchno.20260619 1g In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250805 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250316 5g Out of stock Inquiry
  • Product code: SSC-066756
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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: 1g
  • Available purity: ≥95%
  • 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 1583244-06-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1583244-06-7 / 1-cyclododecyl-3-(2,4,6-trimethylphenyl)imidazol-1-ium chloride

Standard CAS: 1583244-06-7 Multi CAS: No

Basic Information

CAS
1583244-06-7
Multi CAS
No
Molecular Formula
C24H37ClN2
Molecular Weight
389.000000
Exact Mass
388.264527
SMILES
CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)C3CCCCCCCCCCC3)C.[Cl-]
InChI
InChI=1S/C24H37N2.ClH/c1-20-17-21(2)24(22(3)18-20)26-16-15-25(19-26)23-13-11-9-7-5-4-6-8-10-12-14-23;/h15-19,23H,4-14H2,1-3H3;1H/q+1;/p-1
InChIKey
KRODWXYVTUXSFG-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
11
Fraction Csp3
0.62
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
110
TPSA
8.81

LogP / Solubility

WLOGP
3.54
MLOGP
3.14
XLogP3
3.54
Consensus LogP
3.41
Log S (ESOL)
-4.65
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.37
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.58

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
4

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