200,000+ products from a single source!
sales@angenechem.com
832694-93-6 | Urea, N-(4-bromophenyl)-N'-(5,7-dimethyl-2-benzoxazolyl)-
CAS No: 832694-93-6 Catalog No: AG0056RK MDL No:
Product Description
Catalog Number:
AG0056RK
Chemical Name:
Urea, N-(4-bromophenyl)-N'-(5,7-dimethyl-2-benzoxazolyl)-
CAS Number:
832694-93-6
Molecular Formula:
C16H14BrN3O2
Molecular Weight:
360.2053
IUPAC Name:
1-(4-bromophenyl)-3-(5,7-dimethyl-1,3-benzoxazol-2-yl)urea
InChI:
InChI=1S/C16H14BrN3O2/c1-9-7-10(2)14-13(8-9)19-16(22-14)20-15(21)18-12-5-3-11(17)4-6-12/h3-8H,1-2H3,(H2,18,19,20,21)
InChI Key:
NIBGGOQJXMFOSH-UHFFFAOYSA-N
SMILES:
O=C(Nc1nc2c(o1)c(C)cc(c2)C)Nc1ccc(cc1)Br
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
359.027g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
360.211g/mol
Monoisotopic Mass:
359.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.