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102395-71-1

102395-71-1 | 4-Piperidinecarboxylic acid, 1-[[(4-methylphenyl)amino]carbonyl]-4-phenyl-, ethyl ester

CAS No: 102395-71-1 Catalog No: AG0007CJ MDL No:

Product Description

Catalog Number:
AG0007CJ
Chemical Name:
4-Piperidinecarboxylic acid, 1-[[(4-methylphenyl)amino]carbonyl]-4-phenyl-, ethyl ester
CAS Number:
102395-71-1
Molecular Formula:
C22H26N2O3
Molecular Weight:
366.4534
IUPAC Name:
ethyl 1-[(4-methylphenyl)carbamoyl]-4-phenylpiperidine-4-carboxylate
InChI:
InChI=1S/C22H26N2O3/c1-3-27-20(25)22(18-7-5-4-6-8-18)13-15-24(16-14-22)21(26)23-19-11-9-17(2)10-12-19/h4-12H,3,13-16H2,1-2H3,(H,23,26)
InChI Key:
BHCFALRDIZKTII-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CCN(CC1)C(=O)Nc1ccc(cc1)C)c1ccccc1

Properties

Complexity:
500  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.194g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
366.461g/mol
Monoisotopic Mass:
366.194g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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