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CAS 103862-55-1 5-BROMO-8-METHOXY-2-METHYL-QUINOLINE molecular structure lightbox
CAS RN: 103862-55-1

5-BROMO-8-METHOXY-2-METHYL-QUINOLINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250120 25mg / 100mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-005500
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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 103862-55-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

103862-55-1 / 5-bromo-8-methoxy-2-methylquinoline

5-bromo-8-methoxy-2-methylquinoline | 5-bromo-8-methoxy-2-methyl-quinoline | MFCD04966993

Standard CAS: 103862-55-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
103862-55-1
Multi CAS
No
Molecular Formula
C11H10BrNO
Molecular Weight
252.110000
Exact Mass
250.994580
SMILES
CC1=NC2=C(C=CC(=C2C=C1)Br)OC
InChI
InChI=1S/C11H10BrNO/c1-7-3-4-8-9(12)5-6-10(14-2)11(8)13-7/h3-6H,1-2H3
InChIKey
MCBRCJBMVOOJFX-UHFFFAOYSA-N
Synonyms
5-bromo-8-methoxy-2-methylquinoline 5-bromo-8-methoxy-2-methyl-quinoline MFCD04966993 SCHEMBL681786 SCHEMBL27497156

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.18
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
60.73
TPSA
22.12

LogP / Solubility

WLOGP
3.31
MLOGP
2.92
XLogP3
3.3
Consensus LogP
3.18
Log S (ESOL)
-3.95
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.02
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.17
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)
-1.9

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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