CAS RN: 851233-67-5

(2S,4S)-4-hydroxypyrrolidine-2-carboxamide hydrochloride

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251113 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS851233-67-5
  • Purity/Analytical Methods: >99.0%
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851233-67-5 / 4-hydroxypyrrolidine-2-carboxamide;hydrochloride

Standard CAS: 851233-67-5 Multi CAS: Yes

Basic Information

CAS
851233-67-5
Multi CAS
Yes
Molecular Formula
C5H11CLN2O2
Molecular Weight
166.600000
Exact Mass
166.050905
InChI
InChI=1S/C5H10N2O2.ClH/c6-5(9)4-1-3(8)2-7-4;/h3-4,7-8H,1-2H2,(H2,6,9);1H
InChIKey
OICPVUAPEGFLSK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
38.86
TPSA
75.35

LogP / Solubility

WLOGP
-1.38
MLOGP
-1.22
XLogP3
-1.38
Consensus LogP
-1.33
Log S (ESOL)
0.06
Class (ESOL)
Highly soluble
Log S (Ali)
0.07
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.29
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.72

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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