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CAS 113-52-0 Imipramine Hydrochloride molecular structure lightbox
CAS RN: 113-52-0

Imipramine Hydrochloride

Product Availability

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251210 100mg In stock Shanghai Inquiry
Batchno.20250812 1g In stock Shanghai Inquiry
Batchno.20250208 250mg In stock Shanghai Inquiry
Batchno.20250806 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251008 1g In stock Inquiry
Batchno.20260302 250mg In stock Inquiry
  • Product code: SSC-013234
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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: 5g
  • 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 113-52-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

113-52-0 / 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine;hydrochloride

Imipramine hydrochloride | Imipramine Hcl | Tofranil

Standard CAS: 113-52-0 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
113-52-0
Multi CAS
Yes
Molecular Formula
C19H25ClN2
Molecular Weight
316.900000
Exact Mass
316.170627
SMILES
CN(C)CCCN1C2=CC=CC=C2CCC3=CC=CC=C31.Cl
InChI
InChI=1S/C19H24N2.ClH/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21;/h3-6,8-11H,7,12-15H2,1-2H3;1H
InChIKey
XZZXIYZZBJDEEP-UHFFFAOYSA-N
Synonyms
Imipramine hydrochloride Imipramine Hcl Tofranil Pryleugan Presamine

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.37
Rotatable bonds
4
H-bond acceptors
2
H-bond donors
1
Molar refractivity
97.72
TPSA
6.48

LogP / Solubility

WLOGP
4.3
MLOGP
3.8
XLogP3
4.3
Consensus LogP
4.13
Log S (ESOL)
-4.65
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.26
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.77
Class (SILICOS-IT)
Slightly soluble

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
No
Log Kp (skin permeation)
-1.6

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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