CAS RN: 372096-52-1

5-Pyridin-3-yl-thiazol-2-ylaMine

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Batchno.20260415 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: starshine_CAS372096-52-1
  • Purity/Analytical Methods: >99.0%
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372096-52-1 / 5-pyridin-3-yl-1,3-thiazol-2-amine

Standard CAS: 372096-52-1 Multi CAS: No

Basic Information

CAS
372096-52-1
Multi CAS
No
Molecular Formula
C8H7N3S
Molecular Weight
177.230000
Exact Mass
177.036068
InChI
InChI=1S/C8H7N3S/c9-8-11-5-7(12-8)6-2-1-3-10-4-6/h1-5H,(H2,9,11)
InChIKey
APDVGCUZIITDCP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
49.76
TPSA
51.8

LogP / Solubility

WLOGP
1.79
MLOGP
1.57
XLogP3
1.2
Consensus LogP
1.52
Log S (ESOL)
-2.68
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.3
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.42
Class (SILICOS-IT)
Moderately 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)
-2.53

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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