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CAS 6129-15-3 (R)-(+)-N-(1-PHENYLETHYL)MALEIMIDE molecular structure lightbox
CAS RN: 6129-15-3

(R)-(+)-N-(1-PHENYLETHYL)MALEIMIDE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251214 100mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS6129-15-3
  • Purity/Analytical Methods: >99.0%
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6129-15-3 / 1-[(1R)-1-phenylethyl]pyrrole-2,5-dione

Standard CAS: 6129-15-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6129-15-3
Multi CAS
Yes
Molecular Formula
C12H11NO2
Molecular Weight
201.220000
Exact Mass
201.078979
InChI
InChI=1S/C12H11NO2/c1-9(10-5-3-2-4-6-10)13-11(14)7-8-12(13)15/h2-9H,1H3/t9-/m1/s1
InChIKey
PWZXUQWQRVKGAH-SECBINFHSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
55.85
TPSA
37.38

LogP / Solubility

WLOGP
1.67
MLOGP
1.47
XLogP3
1.4
Consensus LogP
1.51
Log S (ESOL)
-2.31
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.42
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.6
Class (SILICOS-IT)
Moderately 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)
-2.76

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

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