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Home > Bromides > 1000339-29-6
1000339-29-6 | 4(3H)-Quinazolinone, 6-bromo-2-cyclohexyl-
CAS No: 1000339-29-6 Catalog No: AG0000CJ MDL No:MFCD09878379
Product Description
Catalog Number:
AG0000CJ
Chemical Name:
4(3H)-Quinazolinone, 6-bromo-2-cyclohexyl-
CAS Number:
1000339-29-6
Molecular Formula:
C14H15BrN2O
Molecular Weight:
307.1857
MDL Number:
MFCD09878379
IUPAC Name:
6-bromo-2-cyclohexyl-3H-quinazolin-4-one
InChI:
InChI=1S/C14H15BrN2O/c15-10-6-7-12-11(8-10)14(18)17-13(16-12)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,16,17,18)
InChI Key:
KAHRETGNIHZMHI-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(=O)[nH]c(n2)C1CCCCC1
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.037g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.191g/mol
Monoisotopic Mass:
306.037g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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