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CAS 315-69-5 Trimipramine Related Compound A (25 mg) (dehydro trimipramine) molecular structure lightbox
CAS RN: 315-69-5

Trimipramine Related Compound A (25 mg) (dehydro trimipramine)

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250218 25mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS315-69-5
  • Purity/Analytical Methods: >99.0%
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315-69-5 / 3-benzo[b][1]benzazepin-11-yl-N,N,2-trimethylpropan-1-amine

Standard CAS: 315-69-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
315-69-5
Multi CAS
Yes
Molecular Formula
C20H24N2
Molecular Weight
292.400000
Exact Mass
292.193949
InChI
InChI=1S/C20H24N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-13,16H,14-15H2,1-3H3
InChIKey
RNFADUFBCJRRPS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.3
Rotatable bonds
4
H-bond acceptors
2
Molar refractivity
96.54
TPSA
6.48

LogP / Solubility

WLOGP
4.51
MLOGP
3.98
XLogP3
4.9
Consensus LogP
4.46
Log S (ESOL)
-4.63
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.21
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.78
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.3

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

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