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N-{[1,1'-biphenyl]-2-yl}-4-methyl-3-(piperidine-1-sulfonyl)benzamide

N-{[1,1'-biphenyl]-2-yl}-4-methyl-3-(piperidine-1-sulfonyl)benzamide

Formula: C25H26N2O3S

SMILES: CC1=C(C=C(C=C1)C(=O)NC1=CC=CC=C1C1=CC=CC=C1)S(=O)(=O)N1CCCCC1

IUPAC: N-{[1,1'-biphenyl]-2-yl}-4-methyl-3-(piperidine-1-sulfonyl)benzamide

InChI: InChI=1S/C25H26N2O3S/c1-19-14-15-21(18-24(19)31(29,30)27-16-8-3-9-17-27)25(28)26-23-13-7-6-12-22(23)20-10-4-2-5-11-20/h2,4-7,10-15,18H,3,8-9,16-17H2,1H3,(H,26,28)

Composition: C (69.10%), H (6.03%), N (6.45%), O (11.05%), S (7.38%)

Molar Mass: 434.55

Atom Count: 57

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 434.166413879
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey VHMXOCUMRUZJIK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 125.86
Topological Polar Surface Area 66.48
Polarizability 49.41
Ring Count 4
Rotatable Bond Count 4

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