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CAS 155370-03-9 2-(4-FLUOROPHENYL)-2,3-DIHYDRO-4(1H)-QUINOLINONE molecular structure lightbox
CAS RN: 155370-03-9

2-(4-FLUOROPHENYL)-2,3-DIHYDRO-4(1H)-QUINOLINONE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250813 100mg In stock Shanghai, Tianjin Inquiry
Batchno.20251117 1g In stock Shenzhen, Tianjin Inquiry
Batchno.20260504 250mg In stock Shenzhen, Tianjin Inquiry
Batchno.20251106 5g Out of stock Inquiry
  • Product code: starshine_CAS155370-03-9
  • Purity/Analytical Methods: >99.0%
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155370-03-9 / 2-(4-fluorophenyl)-2,3-dihydro-1H-quinolin-4-one

Standard CAS: 155370-03-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
155370-03-9
Multi CAS
No
Molecular Formula
C15H12FNO
Molecular Weight
241.260000
Exact Mass
241.090292
SMILES
C1C(NC2=CC=CC=C2C1=O)C3=CC=C(C=C3)F
InChI
InChI=1S/C15H12FNO/c16-11-7-5-10(6-8-11)14-9-15(18)12-3-1-2-4-13(12)17-14/h1-8,14,17H,9H2
InChIKey
HQCCOFMBOJBRQY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
68.15
TPSA
29.1

LogP / Solubility

WLOGP
3.57
MLOGP
3.14
XLogP3
3
Consensus LogP
3.24
Log S (ESOL)
-4.01
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.11
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.31
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)
-1.66

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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