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CAS 874279-11-5 5-(Hydroxymethyl)-2-pyridinecarboxamide molecular structure lightbox
CAS RN: 874279-11-5

5-(Hydroxymethyl)-2-pyridinecarboxamide

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251109 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS874279-11-5
  • Purity/Analytical Methods: >99.0%
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874279-11-5 / 5-(hydroxymethyl)pyridine-2-carboxamide

Standard CAS: 874279-11-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
874279-11-5
Multi CAS
No
Molecular Formula
C7H8N2O2
Molecular Weight
152.150000
Exact Mass
152.058578
InChI
InChI=1S/C7H8N2O2/c8-7(11)6-2-1-5(4-10)3-9-6/h1-3,10H,4H2,(H2,8,11)
InChIKey
NORTZMDIRWCHKY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
38.68
TPSA
76.21

LogP / Solubility

WLOGP
-0.33
MLOGP
-0.29
XLogP3
-0.8
Consensus LogP
-0.47
Log S (ESOL)
-0.85
Class (ESOL)
Very soluble
Log S (Ali)
-0.57
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.62
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)
-3.88

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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