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CAS 65148-09-6 6-Bromo-quinoline-2-carboxylic acid amide molecular structure lightbox
CAS RN: 65148-09-6

6-Bromo-quinoline-2-carboxylic acid amide

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260408 500mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: LINB926911
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65148-09-6 / 6-bromoquinoline-2-carboxamide

Standard CAS: 65148-09-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
65148-09-6
Multi CAS
No
Molecular Formula
BC10H7ORn2
Molecular Weight
251.080000
Exact Mass
249.974180
InChI
InChI=1S/C10H7BrN2O/c11-7-2-4-8-6(5-7)1-3-9(13-8)10(12)14/h1-5H,(H2,12,14)
InChIKey
HCPODGJMFLAPEZ-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
57.96
TPSA
55.98

LogP / Solubility

WLOGP
2.1
MLOGP
1.85
XLogP3
2.1
Consensus LogP
2.02
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.13
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.15
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.76

Drug-likeness / Medicinal Chemistry

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

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