AC1MIPL6

6-cyclohexyl-N-[4-(diethoxyphosphorylmethyl)phenyl]-4-oxo-1H-isothiochromene-1-carboxamide

Also Known As: Phosphonic acid, ((4-(((6-cyclohexyl-3,4-dihydro-4-oxo-1H-2-benzothiopyran-1-yl)carbonyl)amino)phenyl)methyl)-, diethyl ester|6-cyclohexyl-N-[4-(diethoxyphosphorylmethyl)phenyl]-4-oxo-1H-isothiochromene-1-carboxamide|6-cyclohexyl-N-[4-(diethoxyphosphorylmethyl)phenyl]-4-oxo-isothiochroman-1-carboxamide|Diethyl ({4-[(6-cyclohexyl-4-oxo-3,4-dihydro-1H-2-benzothiopyran-1-carbonyl)amino]phenyl}methyl)phosphonate|Diethyl {[4-(6-cyclohexyl-4-oxo-3,4-dihydro-1H-2-benzothiopyran-1-carboxamido)phenyl]methyl}phosphonate

Molecular Formula	C27H34NO5PS
Molecular Weight	515.1895 g/mol
LogP	7.1097
Topological Polar Surface Area	81.7 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	515.1895
Monoisotopic Mass	515.1895
Heavy Atoms	35
Complexity	1087.2505

Chemical Identifiers

CAS Number	131007-47-1
SMILES	CCOP(=O)(CC1=CC=C(C=C1)NC(=O)C2C3=C(C=C(C=C3)C4CCCCC4)C(=O)CS2)OCC