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24826-64-0 | 1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-5-phenyl-1-(2-phenylacetyl)-
CAS No: 24826-64-0 Catalog No: AG002PKZ MDL No:
Product Description
Catalog Number:
AG002PKZ
Chemical Name:
1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-5-phenyl-1-(2-phenylacetyl)-
CAS Number:
24826-64-0
Molecular Formula:
C23H17ClN2O3
Molecular Weight:
404.8457
IUPAC Name:
7-chloro-5-phenyl-1-(2-phenylacetyl)-1,5-benzodiazepine-2,4-dione
InChI:
InChI=1S/C23H17ClN2O3/c24-17-11-12-19-20(14-17)25(18-9-5-2-6-10-18)22(28)15-23(29)26(19)21(27)13-16-7-3-1-4-8-16/h1-12,14H,13,15H2
InChI Key:
SYYZVJYGTBEQGB-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)N(c1ccccc1)C(=O)CC(=O)N2C(=O)Cc1ccccc1
Properties
Complexity:
628
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.093g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
404.85g/mol
Monoisotopic Mass:
404.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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