[email protected]
CAS 31485-02-6 AMpicillin EP IMpurity G molecular structure lightbox
CAS RN: 31485-02-6

AMpicillin EP IMpurity G

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250913 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS31485-02-6
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

31485-02-6 / 3,6-diphenylpiperazine-2,5-dione

Standard CAS: 31485-02-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
31485-02-6
Multi CAS
Yes
Molecular Formula
C16H14N2O2
Molecular Weight
266.290000
Exact Mass
266.105528
InChI
InChI=1S/C16H14N2O2/c19-15-13(11-7-3-1-4-8-11)17-16(20)14(18-15)12-9-5-2-6-10-12/h1-10,13-14H,(H,17,20)(H,18,19)/t13-,14-/m1/s1
InChIKey
BMGJGWGTAAJISM-ZIAGYGMSSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
74.65
TPSA
58.2

LogP / Solubility

WLOGP
1.72
MLOGP
1.52
XLogP3
2.1
Consensus LogP
1.78
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.98
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.05
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5

Customers Also Viewed

Get In Touch

Contact Us