CAS 30345-85-8 | 1-benzylimidazolidine-2,4,5-trione | CAS Number 30345-85-8

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30345-85-8 | 1-benzylimidazolidine-2,4,5-trione

CAS No: 30345-85-8 Catalog No: AG00IW23 MDL No:MFCD01314649

Product Description

Catalog Number:

AG00IW23

Chemical Name:

1-benzylimidazolidine-2,4,5-trione

CAS Number:

30345-85-8

Molecular Formula:

C10H8N2O3

Molecular Weight:

204.1821

MDL Number:

MFCD01314649

IUPAC Name:

1-benzylimidazolidine-2,4,5-trione

InChI:

InChI=1S/C10H8N2O3/c13-8-9(14)12(10(15)11-8)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,13,15)

InChI Key:

GGLAGGHAVVZWSQ-UHFFFAOYSA-N

SMILES:

O=C1NC(=O)C(=O)N1Cc1ccccc1

Properties

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.185g/mol

Monoisotopic Mass:

204.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8

Literature

Title	Journal
Structure-activity relationship of 2,4,5-trioxoimidazolidines as inhibitors of thymidine phosphorylase.	European journal of medicinal chemistry 20110401
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501