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CAS 284682-27-5 5-HYDROXYPYRIMIDINE molecular structure lightbox
CAS RN: 284682-27-5

5-HYDROXYPYRIMIDINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250826 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS284682-27-5
  • Purity/Analytical Methods: >99.0%
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284682-27-5 / pyrimidin-5-ol

Standard CAS: 284682-27-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
284682-27-5
Multi CAS
No
Molecular Formula
C4H4N2O
Molecular Weight
96.090000
Exact Mass
96.032363
SMILES
C1=C(C=NC=N1)O
InChI
InChI=1S/C4H4N2O/c7-4-1-5-3-6-2-4/h1-3,7H
InChIKey
LTXJLQINBYSQFU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
23.7
TPSA
46.01

LogP / Solubility

WLOGP
0.18
MLOGP
0.15
XLogP3
-0.4
Consensus LogP
-0.02
Log S (ESOL)
-1.18
Class (ESOL)
Soluble
Log S (Ali)
-0.48
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.44
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)
-3.18

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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