CAS RN: 59341-68-3

2-(4-PYRIDYL)-4-HYDROXY-6-MENTHYL PYRIMIDINE

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Batchno.20260608 100mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS59341-68-3
  • Purity/Analytical Methods: >99.0%
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59341-68-3 / 4-methyl-2-pyridin-4-yl-1H-pyrimidin-6-one

Standard CAS: 59341-68-3 Multi CAS: Yes

Basic Information

CAS
59341-68-3
Multi CAS
Yes
Molecular Formula
C10H9N3O
Molecular Weight
187.200000
Exact Mass
187.074562
InChI
InChI=1S/C10H9N3O/c1-7-6-9(14)13-10(12-7)8-2-4-11-5-3-8/h2-6H,1H3,(H,12,13,14)
InChIKey
UFMQZZRBKSOEKS-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
12
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
52.83
TPSA
58.64

LogP / Solubility

WLOGP
1.14
MLOGP
1
XLogP3
0.2
Consensus LogP
0.78
Log S (ESOL)
-2.29
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.92
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
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)
-3.05

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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