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CAS 929622-08-2 Bavisant molecular structure lightbox
CAS RN: 929622-08-2

Bavisant

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260604 5mg / 25mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS929622-08-2
  • Purity/Analytical Methods: >99.0%
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929622-08-2 / (4-cyclopropylpiperazin-1-yl)-[4-(morpholin-4-ylmethyl)phenyl]methanone

Standard CAS: 929622-08-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
929622-08-2
Multi CAS
No
Molecular Formula
C19H27N3O2
Molecular Weight
329.400000
Exact Mass
329.210327
InChI
InChI=1S/C19H27N3O2/c23-19(22-9-7-21(8-10-22)18-5-6-18)17-3-1-16(2-4-17)15-20-11-13-24-14-12-20/h1-4,18H,5-15H2
InChIKey
BGBVSGSIXIIREO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.63
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
93.04
TPSA
36.02

LogP / Solubility

WLOGP
1.44
MLOGP
1.28
XLogP3
1.2
Consensus LogP
1.31
Log S (ESOL)
-2.71
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.48
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.71

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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