Oprea1_746122

ethyl 2-[[2-[1-[2-(naphthalene-2-carbonylamino)ethyl]indol-3-yl]sulfanylacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Also Known As: Oprea1_746122|F0554-0844|ethyl 2-{2-[(1-{2-[(naphthalen-2-yl)formamido]ethyl}-1H-indol-3-yl)sulfanyl]acetamido}-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate|ethyl 2-(2-((1-(2-(2-naphthamido)ethyl)-1H-indol-3-yl)thio)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|ethyl 2-[[2-[1-[2-(naphthalene-2-carbonylamino)ethyl]indol-3-yl]sulfanylacetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|ethyl 3-[({1-[2-(2-naphthylamino)ethyl]-3-indolylthio}methyl)carbonylamino]-2-thiabicyclo[3.3.0]octa-1(5),3-diene-4-carboxylate

Molecular Formula	C33H31N3O4S2
Molecular Weight	597.1756 g/mol
LogP	6.6822
Topological Polar Surface Area	89.43 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	597.1756
Monoisotopic Mass	597.1756
Heavy Atoms	42
Complexity	1806.0125

Chemical Identifiers

CAS Number	533865-70-2
SMILES	CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC6=CC=CC=C6C=C5