CAS RN: 1427503-36-3

7-Hydroxy-2-Methyl-6-azaindole

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Batchno.20250518 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1427503-36-3
  • Purity/Analytical Methods: >99.0%
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1427503-36-3 / 2-methyl-1,6-dihydropyrrolo[2,3-c]pyridin-7-one

Standard CAS: 1427503-36-3 Multi CAS: No

Basic Information

CAS
1427503-36-3
Multi CAS
No
Molecular Formula
C8H8N2O
Molecular Weight
148.160000
Exact Mass
148.063663
SMILES
CC1=CC2=C(N1)C(=O)NC=C2
InChI
InChI=1S/C8H8N2O/c1-5-4-6-2-3-9-8(11)7(6)10-5/h2-4,10H,1H3,(H,9,11)
InChIKey
CQEACWYFDQQSTB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.12
H-bond acceptors
1
H-bond donors
2
Molar refractivity
43.66
TPSA
48.65

LogP / Solubility

WLOGP
1.16
MLOGP
1.02
XLogP3
0.9
Consensus LogP
1.03
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.62
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.59
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)
-2.8

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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