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112629-61-5

112629-61-5 | Imidazolidine, 1,3-dibenzoyl-2-(4-methoxyphenyl)-

CAS No: 112629-61-5 Catalog No: AG00822K MDL No:

Product Description

Catalog Number:
AG00822K
Chemical Name:
Imidazolidine, 1,3-dibenzoyl-2-(4-methoxyphenyl)-
CAS Number:
112629-61-5
Molecular Formula:
C24H22N2O3
Molecular Weight:
386.4431
IUPAC Name:
[3-benzoyl-2-(4-methoxyphenyl)imidazolidin-1-yl]-phenylmethanone
InChI:
InChI=1S/C24H22N2O3/c1-29-21-14-12-18(13-15-21)22-25(23(27)19-8-4-2-5-9-19)16-17-26(22)24(28)20-10-6-3-7-11-20/h2-15,22H,16-17H2,1H3
InChI Key:
GSDHDSCCNAWDCB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1N(CCN1C(=O)c1ccccc1)C(=O)c1ccccc1

Properties

Complexity:
523  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.163g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.451g/mol
Monoisotopic Mass:
386.163g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

Literature

Title Journal
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

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