CAS RN: 1386457-72-2

7-methyl-1H-Pyrazolo[3,4-c]pyridine

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Batchno.20250531 100mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1386457-72-2
  • Purity/Analytical Methods: >99.0%
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1386457-72-2 / 7-methyl-1H-pyrazolo[5,4-c]pyridine

Standard CAS: 1386457-72-2 Multi CAS: No

Basic Information

CAS
1386457-72-2
Multi CAS
No
Molecular Formula
C7H7N3
Molecular Weight
133.150000
Exact Mass
133.063997
SMILES
CC1=NC=CC2=C1NN=C2
InChI
InChI=1S/C7H7N3/c1-5-7-6(2-3-8-5)4-9-10-7/h2-4H,1H3,(H,9,10)
InChIKey
BVSNICZSOABKHZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.63
TPSA
41.57

LogP / Solubility

WLOGP
1.27
MLOGP
1.11
XLogP3
0.9
Consensus LogP
1.09
Log S (ESOL)
-2.13
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.57
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.58
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)
-2.63

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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