Home Other Building Blocks 3-[(4-methylphenyl)formamido]-3-phenylpropanoic acid

3-[(4-methylphenyl)formamido]-3-phenylpropanoic acid

CAS No.:
452347-19-2
Catalog Number:
AG01AB3A
Molecular Formula:
C17H17NO3
Molecular Weight:
283.3218
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Product Description
Catalog Number:
AG01AB3A
Chemical Name:
3-[(4-methylphenyl)formamido]-3-phenylpropanoic acid
CAS Number:
452347-19-2
Molecular Formula:
C17H17NO3
Molecular Weight:
283.3218
MDL Number:
MFCD00563403
IUPAC Name:
3-[(4-methylbenzoyl)amino]-3-phenylpropanoic acid
InChI:
InChI=1S/C17H17NO3/c1-12-7-9-14(10-8-12)17(21)18-15(11-16(19)20)13-5-3-2-4-6-13/h2-10,15H,11H2,1H3,(H,18,21)(H,19,20)
InChI Key:
LNVSLBPGTFVMMP-UHFFFAOYSA-N
SMILES:
OC(=O)CC(c1ccccc1)NC(=O)c1ccc(cc1)C
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.121g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
283.327g/mol
Monoisotopic Mass:
283.121g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties