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CAS 1070879-51-4 4-BROMO-7-CHLORO-2-METHYLQUINOLINE molecular structure lightbox
CAS RN: 1070879-51-4

4-BROMO-7-CHLORO-2-METHYLQUINOLINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260525 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-008531
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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 1070879-51-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1070879-51-4 / 4-bromo-7-chloro-2-methylquinoline

4-Bromo-7-chloro-2-methylquinoline | MFCD11505136 | DTXSID30653700

Standard CAS: 1070879-51-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1070879-51-4
Multi CAS
No
Molecular Formula
C10H7BrClN
Molecular Weight
256.520000
Exact Mass
254.945040
SMILES
CC1=CC(=C2C=CC(=CC2=N1)Cl)Br
InChI
InChI=1S/C10H7BrClN/c1-6-4-9(11)8-3-2-7(12)5-10(8)13-6/h2-5H,1H3
InChIKey
CTTIWQURANSXAG-UHFFFAOYSA-N
Synonyms
4-Bromo-7-chloro-2-methylquinoline MFCD11505136 DTXSID30653700 4-bromo-7-chloro-2-methyl-quinoline SB69756

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
Fraction Csp3
0.1
H-bond acceptors
1
Molar refractivity
59.19
TPSA
12.89

LogP / Solubility

WLOGP
3.96
MLOGP
3.49
XLogP3
3.9
Consensus LogP
3.78
Log S (ESOL)
-4.49
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.52
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.61
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.47

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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