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CAS 1201845-11-5 6-bromo-N-methylquinolin-2-amine molecular structure lightbox
CAS RN: 1201845-11-5

6-bromo-N-methylquinolin-2-amine

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250227 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-020996
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1201845-11-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1201845-11-5 / 6-bromo-N-methylquinolin-2-amine

6-bromo-N-methylquinolin-2-amine | MFCD19678528 | SCHEMBL1544058

Standard CAS: 1201845-11-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1201845-11-5
Multi CAS
No
Molecular Formula
C10H9BrN2
Molecular Weight
237.100000
Exact Mass
235.994910
SMILES
CNC1=NC2=C(C=C1)C=C(C=C2)Br
InChI
InChI=1S/C10H9BrN2/c1-12-10-5-2-7-6-8(11)3-4-9(7)13-10/h2-6H,1H3,(H,12,13)
InChIKey
OISUPOCLWBILRG-UHFFFAOYSA-N
Synonyms
6-bromo-N-methylquinolin-2-amine MFCD19678528 SCHEMBL1544058 6-Bromo-N-methyl-2-quinolinamine 6-bromo-N-methyl-quinolin-2-amine

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
58.99
TPSA
24.92

LogP / Solubility

WLOGP
3.04
MLOGP
2.68
XLogP3
3.2
Consensus LogP
2.97
Log S (ESOL)
-3.73
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.7
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.84
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.01

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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