CAS RN: 1159827-11-8
7-Cyano-6-azaindole
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
| Batchno.20251109 |
100mg / 250mg / 1g |
Confirm by inquiry |
Shanghai | Inquiry |
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Product code:
starshine_CAS1159827-11-8
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Purity/Analytical Methods:
>99.0%
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1159827-11-8 / 1H-pyrrolo[2,3-c]pyridine-7-carbonitrile
1H-Pyrrolo[2,3-c]pyridine-7-carbonitrile | 7-Cyano-6-azaindole | MFCD12401020
Standard CAS: 1159827-11-8
Multi CAS: No
Basic Information
CAS
1159827-11-8
Multi CAS
No
Molecular Formula
C8H5N3
Molecular Weight
143.150000
Exact Mass
143.048347
SMILES
C1=CNC2=C1C=CN=C2C#N
InChI
InChI=1S/C8H5N3/c9-5-7-8-6(1-3-10-7)2-4-11-8/h1-4,11H
InChIKey
LHEOHLOKJZRGSR-UHFFFAOYSA-N
Synonyms
1H-Pyrrolo[2,3-c]pyridine-7-carbonitrile
7-Cyano-6-azaindole
MFCD12401020
AKOS016010760
PB29989
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
2
H-bond donors
1
Molar refractivity
40.81
TPSA
52.47
LogP / Solubility
WLOGP
1.43
MLOGP
1.26
XLogP3
1
Consensus LogP
1.23
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.77
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.78
Class (SILICOS-IT)
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)
-2.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5