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CAS 1150617-64-3 7-chloro-1-(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine molecular structure lightbox
CAS RN: 1150617-64-3

7-chloro-1-(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine

  • Product code: SSC-014778
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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 1150617-64-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1150617-64-3 / 7-chloro-1-propan-2-ylpyrrolo[2,3-c]pyridine

7-chloro-1-isopropyl-1H-pyrrolo[2,3-c]pyridine | 7-Chloro-1-(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine | 7-chloro-1-propan-2-ylpyrrolo[2,3-c]pyridine

Standard CAS: 1150617-64-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1150617-64-3
Multi CAS
No
Molecular Formula
C10H11ClN2
Molecular Weight
194.660000
Exact Mass
194.061076
SMILES
CC(C)N1C=CC2=C1C(=NC=C2)Cl
InChI
InChI=1S/C10H11ClN2/c1-7(2)13-6-4-8-3-5-12-10(11)9(8)13/h3-7H,1-2H3
InChIKey
GLBBWDZEMFWXGO-UHFFFAOYSA-N
Synonyms
7-chloro-1-isopropyl-1H-pyrrolo[2,3-c]pyridine 7-Chloro-1-(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine 7-chloro-1-propan-2-ylpyrrolo[2,3-c]pyridine 7-Chloro-1-isopropyl-6-azaindole MFCD12024540

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Fraction Csp3
0.3
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
55.13
TPSA
17.82

LogP / Solubility

WLOGP
3.27
MLOGP
2.88
XLogP3
2.6
Consensus LogP
2.92
Log S (ESOL)
-3.55
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.52
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.76
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)
-1.59

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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