CAS RN: 2372-96-5

N-VINYLSUCCINIMIDE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260419 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS2372-96-5
  • Purity/Analytical Methods: >99.0%
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2372-96-5 / 1-ethenylpyrrolidine-2,5-dione

Standard CAS: 2372-96-5 Multi CAS: No

Basic Information

CAS
2372-96-5
Multi CAS
No
Molecular Formula
C6H7NO2
Molecular Weight
125.130000
Exact Mass
125.047678
SMILES
C=CN1C(=O)CCC1=O
InChI
InChI=1S/C6H7NO2/c1-2-7-5(8)3-4-6(7)9/h2H,1,3-4H2
InChIKey
VOCDJQSAMZARGX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
31.28
TPSA
37.38

LogP / Solubility

WLOGP
0.28
MLOGP
0.24
XLogP3
-0.4
Consensus LogP
0.04
Log S (ESOL)
-0.73
Class (ESOL)
Very soluble
Log S (Ali)
-0.79
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.82
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)
-3.29

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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