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827612-36-2 | Urea, N-[(1R)-1-(hydroxymethyl)-2-phenylethyl]-N'-phenyl-
CAS No: 827612-36-2 Catalog No: AG0056ZK MDL No:
Product Description
Catalog Number:
AG0056ZK
Chemical Name:
Urea, N-[(1R)-1-(hydroxymethyl)-2-phenylethyl]-N'-phenyl-
CAS Number:
827612-36-2
Molecular Formula:
C16H18N2O2
Molecular Weight:
270.3263
IUPAC Name:
1-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-3-phenylurea
InChI:
InChI=1S/C16H18N2O2/c19-12-15(11-13-7-3-1-4-8-13)18-16(20)17-14-9-5-2-6-10-14/h1-10,15,19H,11-12H2,(H2,17,18,20)/t15-/m1/s1
InChI Key:
XIWZYXYULUDTSB-OAHLLOKOSA-N
SMILES:
OC[C@H](NC(=O)Nc1ccccc1)Cc1ccccc1
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
270.137g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
270.332g/mol
Monoisotopic Mass:
270.137g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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