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CAS 924633-09-0 2(1H)-Quinolinone, 6-bromo-3-(phenylmethyl)- molecular structure lightbox
CAS RN: 924633-09-0

2(1H)-Quinolinone, 6-bromo-3-(phenylmethyl)-

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250621 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS924633-09-0
  • Purity/Analytical Methods: >99.0%
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924633-09-0 / 3-benzyl-6-bromo-1H-quinolin-2-one

Standard CAS: 924633-09-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
924633-09-0
Multi CAS
Yes
Molecular Formula
BC16H12ORn
Molecular Weight
314.180000
Exact Mass
313.010230
InChI
InChI=1S/C16H12BrNO/c17-14-6-7-15-12(10-14)9-13(16(19)18-15)8-11-4-2-1-3-5-11/h1-7,9-10H,8H2,(H,18,19)
InChIKey
NYAOVIBBTKTYMI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
16
Fraction Csp3
0.06
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
81.52
TPSA
32.86

LogP / Solubility

WLOGP
3.88
MLOGP
3.43
XLogP3
4
Consensus LogP
3.77
Log S (ESOL)
-4.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.94
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.16
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.88

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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