[email protected]
CAS 313273-62-0 3-Acetyl-4-phenyl-1H-quinolin-2-one molecular structure lightbox
CAS RN: 313273-62-0

3-Acetyl-4-phenyl-1H-quinolin-2-one

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251021 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS313273-62-0
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

313273-62-0 / 3-acetyl-4-phenyl-1H-quinolin-2-one

Standard CAS: 313273-62-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
313273-62-0
Multi CAS
Yes
Molecular Formula
C17H13NO2
Molecular Weight
263.290000
Exact Mass
263.094629
InChI
InChI=1S/C17H13NO2/c1-11(19)15-16(12-7-3-2-4-8-12)13-9-5-6-10-14(13)18-17(15)20/h2-10H,1H3,(H,18,20)
InChIKey
UVIFCFBKDKJCFD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
16
Fraction Csp3
0.06
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
80.01
TPSA
49.93

LogP / Solubility

WLOGP
3.4
MLOGP
3
XLogP3
2.4
Consensus LogP
2.93
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.43
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us