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918329-12-1 | Urea, N-[2-(2-benzoxazolyl)phenyl]-N'-phenyl-
CAS No: 918329-12-1 Catalog No: AG006GCS MDL No:
Product Description
Catalog Number:
AG006GCS
Chemical Name:
Urea, N-[2-(2-benzoxazolyl)phenyl]-N'-phenyl-
CAS Number:
918329-12-1
Molecular Formula:
C20H15N3O2
Molecular Weight:
329.3520
IUPAC Name:
1-[2-(1,3-benzoxazol-2-yl)phenyl]-3-phenylurea
InChI:
InChI=1S/C20H15N3O2/c24-20(21-14-8-2-1-3-9-14)23-16-11-5-4-10-15(16)19-22-17-12-6-7-13-18(17)25-19/h1-13H,(H2,21,23,24)
InChI Key:
YQAYCMNADYMMEP-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1c1nc2c(o1)cccc2)Nc1ccccc1
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.116g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
329.359g/mol
Monoisotopic Mass:
329.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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