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24863-09-0 | 1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-(2-chloroacetyl)-5-phenyl-
CAS No: 24863-09-0 Catalog No: AG002PP0 MDL No:
Product Description
Catalog Number:
AG002PP0
Chemical Name:
1H-1,5-Benzodiazepine-2,4(3H,5H)-dione, 7-chloro-1-(2-chloroacetyl)-5-phenyl-
CAS Number:
24863-09-0
Molecular Formula:
C17H12Cl2N2O3
Molecular Weight:
363.1948
IUPAC Name:
7-chloro-1-(2-chloroacetyl)-5-phenyl-1,5-benzodiazepine-2,4-dione
InChI:
InChI=1S/C17H12Cl2N2O3/c18-10-17(24)21-13-7-6-11(19)8-14(13)20(15(22)9-16(21)23)12-4-2-1-3-5-12/h1-8H,9-10H2
InChI Key:
IMRBIDCBCVNCIE-UHFFFAOYSA-N
SMILES:
ClCC(=O)N1C(=O)CC(=O)N(c2c1ccc(c2)Cl)c1ccccc1
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.022g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
363.194g/mol
Monoisotopic Mass:
362.022g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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