CAS RN: 61443-78-5
8-HYDROXY AMOXAPINE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250826 | 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS61443-78-5
- Purity/Analytical Methods: >99.0%
61443-78-5 / 8-chloro-6-piperazin-1-ylbenzo[b][1,4]benzoxazepin-3-ol
Basic Information
CAS
61443-78-5
Multi CAS
Yes
Molecular Formula
C17H16CLN3O2
Molecular Weight
329.800000
Exact Mass
329.093105
InChI
InChI=1S/C17H16ClN3O2/c18-11-1-3-15-13(9-11)17(21-7-5-19-6-8-21)20-14-10-12(22)2-4-16(14)23-15/h1-4,9-10,19,22H,5-8H2
InChIKey
QDWNOKXUZTYVGO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
12
Fraction Csp3
0.24
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
2
Molar refractivity
90.27
TPSA
57.09
LogP / Solubility
WLOGP
3.13
MLOGP
2.77
XLogP3
2.2
Consensus LogP
2.7
Log S (ESOL)
-4.25
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.53
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.41
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.51
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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