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305804-86-8 | 4(3H)-Quinazolinone, 6-bromo-2-hydrazinyl-3-(phenylmethyl)-
CAS No: 305804-86-8 Catalog No: AG0030KX MDL No:
Product Description
Catalog Number:
AG0030KX
Chemical Name:
4(3H)-Quinazolinone, 6-bromo-2-hydrazinyl-3-(phenylmethyl)-
CAS Number:
305804-86-8
Molecular Formula:
C15H13BrN4O
Molecular Weight:
345.1939
IUPAC Name:
3-benzyl-6-bromo-2-hydrazinylquinazolin-4-one
InChI:
InChI=1S/C15H13BrN4O/c16-11-6-7-13-12(8-11)14(21)20(15(18-13)19-17)9-10-4-2-1-3-5-10/h1-8H,9,17H2,(H,18,19)
InChI Key:
VLPOXQZXEKEYHY-UHFFFAOYSA-N
SMILES:
NNc1nc2ccc(cc2c(=O)n1Cc1ccccc1)Br
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.027g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
345.2g/mol
Monoisotopic Mass:
344.027g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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