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CAS 31009-03-7 7-FLUOROQUINOLINE-4-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 31009-03-7

7-FLUOROQUINOLINE-4-CARBOXYLIC ACID

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250728 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS31009-03-7
  • Purity/Analytical Methods: >99.0%
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31009-03-7 / 7-fluoroquinoline-4-carboxylic acid

Standard CAS: 31009-03-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
31009-03-7
Multi CAS
No
Molecular Formula
C10FH6NO2
Molecular Weight
191.160000
Exact Mass
191.038257
InChI
InChI=1S/C10H6FNO2/c11-6-1-2-7-8(10(13)14)3-4-12-9(7)5-6/h1-5H,(H,13,14)
InChIKey
QIRLJMJLJXBUMP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
48.66
TPSA
50.19

LogP / Solubility

WLOGP
2.07
MLOGP
1.82
XLogP3
1.9
Consensus LogP
1.93
Log S (ESOL)
-2.79
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.74
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.41

Drug-likeness / Medicinal Chemistry

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

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