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CAS 885272-38-8 2-Bromo-1H-Pyrrolo[2,3-C]Pyridine molecular structure lightbox
CAS RN: 885272-38-8

2-Bromo-1H-Pyrrolo[2,3-C]Pyridine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250826 100mg / 250mg / 500mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS885272-38-8
  • Purity/Analytical Methods: >99.0%
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885272-38-8 / 2-bromo-1H-pyrrolo[2,3-c]pyridine

Standard CAS: 885272-38-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
885272-38-8
Multi CAS
No
Molecular Formula
BC7H5Rn2
Molecular Weight
197.030000
Exact Mass
195.963610
InChI
InChI=1S/C7H5BrN2/c8-7-3-5-1-2-9-4-6(5)10-7/h1-4,10H
InChIKey
ICMHSGZQLSJRPY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
43.79
TPSA
28.68

LogP / Solubility

WLOGP
2.33
MLOGP
2.05
XLogP3
2
Consensus LogP
2.13
Log S (ESOL)
-3.19
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.85
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.87
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)
-2.27

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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