1-{[(4-methoxyphenyl)methyl]sulfanyl}-8-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-{[(4-methoxyphenyl)methyl]sulfanyl}-8-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-{[(4-methoxyphenyl)methyl]sulfanyl}-8-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | 6280-0639 |
| Compound Name: | 1-{[(4-methoxyphenyl)methyl]sulfanyl}-8-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 488.63 |
| Molecular Formula: | C26 H24 N4 O2 S2 |
| Smiles: | CC1CCc2c3C(N(c4ccccc4)c4nnc(n4c3sc2C1)SCc1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3975 |
| logD: | 5.3975 |
| logSw: | -5.4818 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.617 |
| InChI Key: | MPNHPIMXNFEKMP-MRXNPFEDSA-N |