AC1LUBKQ

3-(4-methoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Also Known As: 3-(4-methoxyphenyl)-2-[(4-nitrobenzyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one|3-(4-Methoxyphenyl)-2-((4-nitrobenzyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|3-(4-METHOXYPHENYL)-2-((4-NITROBENZYL)SULFANYL)-5,6,7,8-TETRAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-4(3H)-ONE|3-(4-methoxyphenyl)-2-[(4-nitrophenyl)methylsulfanyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|3-(4-methoxyphenyl)-2-[(4-nitrophenyl)methylthio]-3,5,6,7,8-pentahydrobenzo[b] thiopheno[2,3-d]pyrimidin-4-one|4-(4-methoxyphenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|650-713-1

Molecular Formula	C24H21N3O4S2
Molecular Weight	479.09735 g/mol
LogP	5.5351
Topological Polar Surface Area	87.26 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	479.09735
Monoisotopic Mass	479.09735
Heavy Atoms	33
Complexity	1392.7445

Chemical Identifiers

CAS Number	477331-59-2
SMILES	COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=C(C=C4)[N+](=O)[O-])SC5=C3CCCC5