AC1NXXV6

6-[[(E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]hexanoic acid

Also Known As: (E)-6-(3-(3,4-diethoxyphenyl)-2-(2-methylbenzamido)acrylamido)hexanoic acid|6-[[(E)-3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]hexanoic acid|6-[[3-(3,4-diethoxyphenyl)-2-[(2-methylbenzoyl)amino]prop-2-enoyl]amino]hexanoic Acid|6-{[(2E)-3-(3,4-diethoxyphenyl)-2-{[(2-methylphenyl)carbonyl]amino}prop-2-enoyl]amino}hexanoic acid

Molecular Formula	C27H34N2O6
Molecular Weight	482.2417 g/mol
LogP	4.32452
Topological Polar Surface Area	113.96 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	14
Exact Mass	482.2417
Monoisotopic Mass	482.2417
Heavy Atoms	35
Complexity	1047.717

Chemical Identifiers

CAS Number	799809-42-0
SMILES	CCOC1=C(C=C(C=C1)/C=C(\C(=O)NCCCCCC(=O)O)/NC(=O)C2=CC=CC=C2C)OCC