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CAS 115170-40-6 5-BROMO-2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE molecular structure lightbox
CAS RN: 115170-40-6

5-BROMO-2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250131 1g / 5g / 10g / 25g Out of stock 5-7 business days Inquiry
  • Product code: SSC-014858
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 10g, 25g, 5g
  • Available purity: >97%
  • Inventory rows with stock: 5
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 115170-40-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >97% 3 In Stock Beijing Inquiry
1g >97% 3 In Stock Hong Kong Inquiry
10g >97% 2 In Stock Shanghai Inquiry
25g >97% 2 In Stock Hong Kong Inquiry
5g >97% 1 In Stock Beijing Inquiry

115170-40-6 / 5-bromo-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine

5-BROMO-2,3-DIHYDRO-7-AZAINDOLE | RefChem:532931 | 634-550-3

Standard CAS: 115170-40-6 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
115170-40-6
Multi CAS
Yes
Molecular Formula
C7H7BrN2
Molecular Weight
199.050000
Exact Mass
197.979260
SMILES
C1CNC2=C1C=C(C=N2)Br
InChI
InChI=1S/C7H7BrN2/c8-6-3-5-1-2-9-7(5)10-4-6/h3-4H,1-2H2,(H,9,10)
InChIKey
UZGNFPCHQUHZAI-UHFFFAOYSA-N
Synonyms
5-BROMO-2,3-DIHYDRO-7-AZAINDOLE RefChem:532931 634-550-3 5-Bromo-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine 5-bromo-1H,2H,3H-pyrrolo[2,3-b]pyridine

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.29
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.13
TPSA
24.92

LogP / Solubility

WLOGP
1.81
MLOGP
1.59
XLogP3
1.9
Consensus LogP
1.77
Log S (ESOL)
-2.66
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.5
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.46
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.65

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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