AC1NE68V

ethyl 2-(adamantane-1-carbonylamino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Also Known As: Oprea1_108344|AK-968/40729941|ethyl 2-(adamantane-1-carbonylamino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-[(1-adamantylcarbonyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 6-phenyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-(adamantane-1-carboxamido)-6-phenyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ethyl 2-(adamantanylcarbonylamino)-6-phenyl-4,5,6,7-tetrahydrobenzo[b]thiophen e-3-carboxylate

Molecular Formula	C28H33NO3S
Molecular Weight	463.2181 g/mol
LogP	6.3522
Topological Polar Surface Area	55.4 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	463.2181
Monoisotopic Mass	463.2181
Heavy Atoms	33
Complexity	1037.0275

Chemical Identifiers

CAS Number	445016-82-0
SMILES	CCOC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)C5