4-(3-chlorophenyl)-1-{[(2,4-dichlorophenyl)methyl]sulfanyl}-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-(3-chlorophenyl)-1-{[(2,4-dichlorophenyl)methyl]sulfanyl}-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-(3-chlorophenyl)-1-{[(2,4-dichlorophenyl)methyl]sulfanyl}-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | 8019-5920 |
| Compound Name: | 4-(3-chlorophenyl)-1-{[(2,4-dichlorophenyl)methyl]sulfanyl}-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 533.88 |
| Molecular Formula: | C23 H15 Cl3 N4 O S2 |
| Smiles: | C1Cc2c3C(N(c4cccc(c4)[Cl])c4nnc(n4c3sc2C1)SCc1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.0178 |
| logD: | 7.0178 |
| logSw: | -6.8591 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.439 |
| InChI Key: | DEHWWTMFHACBSP-UHFFFAOYSA-N |