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CAS 117332-47-5 3,4-Dichloro-5-azaindole molecular structure lightbox
CAS RN: 117332-47-5

3,4-Dichloro-5-azaindole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260116 100mg / 250mg Out of stock 15 business days Inquiry
  • Product code: SSC-017195
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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 117332-47-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

117332-47-5 / 3,4-dichloro-1H-pyrrolo[3,2-c]pyridine

3,4-Dichloro-1H-pyrrolo[3,2-c]pyridine | 1H-Pyrrolo[3,2-c]pyridine, 3,4-dichloro- | MFCD12963262

Standard CAS: 117332-47-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
117332-47-5
Multi CAS
No
Molecular Formula
C7H4Cl2N2
Molecular Weight
187.020000
Exact Mass
185.975154
SMILES
C1=CN=C(C2=C1NC=C2Cl)Cl
InChI
InChI=1S/C7H4Cl2N2/c8-4-3-11-5-1-2-10-7(9)6(4)5/h1-3,11H
InChIKey
GLQFIQWONRCSGP-UHFFFAOYSA-N
Synonyms
3,4-Dichloro-1H-pyrrolo[3,2-c]pyridine 1H-Pyrrolo[3,2-c]pyridine, 3,4-dichloro- MFCD12963262 3,4-DICHLORO-5-AZAINDOLE DTXSID30556065

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
1
Molar refractivity
46.11
TPSA
28.68

LogP / Solubility

WLOGP
2.87
MLOGP
2.52
XLogP3
2.6
Consensus LogP
2.66
Log S (ESOL)
-3.41
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.17
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.26
Class (SILICOS-IT)
Poorly 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)
-1.82

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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