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CAS 33631-21-9 3-Amino-pyridin-2-ol hydrochloride molecular structure lightbox
CAS RN: 33631-21-9

3-Amino-pyridin-2-ol hydrochloride

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251024 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS33631-21-9
  • Purity/Analytical Methods: >99.0%
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33631-21-9 / 3-amino-1H-pyridin-2-one;hydrochloride

Standard CAS: 33631-21-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
33631-21-9
Multi CAS
Yes
Molecular Formula
C5H7CLN2O
Molecular Weight
146.570000
Exact Mass
146.024691
InChI
InChI=1S/C5H6N2O.ClH/c6-4-2-1-3-7-5(4)8;/h1-3H,6H2,(H,7,8);1H
InChIKey
YJQBZFOBZMDVHX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
2
H-bond donors
2
Molar refractivity
38.72
TPSA
58.88

LogP / Solubility

WLOGP
0.38
MLOGP
0.33
XLogP3
0.38
Consensus LogP
0.36
Log S (ESOL)
-1.48
Class (ESOL)
Soluble
Log S (Ali)
-1.04
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.93
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)
-3.35

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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