CAS RN: 70254-45-4

2,4-Pyridinediol,6-methyl-(9CI)

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5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251115 25g / 100g / 500g Confirm by inquiry Shanghai 5-7 business days Inquiry
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Batchno.20250119 100g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250708 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250811 500g In stock Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20250830 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: starshine_CAS70254-45-4
  • Purity/Analytical Methods: >99.0%
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70254-45-4 / 6-methyl-1H-pyridine-2,4-dione

Standard CAS: 70254-45-4 Multi CAS: Yes

Basic Information

CAS
70254-45-4
Multi CAS
Yes
Molecular Formula
C6H7NO2
Molecular Weight
125.130000
Exact Mass
125.047678
InChI
InChI=1S/C6H7NO2/c1-4-2-5(8)3-6(9)7-4/h2-3H,1H3,(H2,7,8,9)
InChIKey
WKGSLYHMRQRARV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.33
H-bond acceptors
2
H-bond donors
1
Molar refractivity
31.52
TPSA
46.17

LogP / Solubility

WLOGP
-0.02
MLOGP
-0.03
XLogP3
-0.3
Consensus LogP
-0.12
Log S (ESOL)
-0.6
Class (ESOL)
Very soluble
Log S (Ali)
-0.57
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.46
Class (SILICOS-IT)
Very 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)
-3.5

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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