7-benzyl-2-{[(4-methoxyphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-benzyl-2-{[(4-methoxyphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
7-benzyl-2-{[(4-methoxyphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4333-3840 |
| Compound Name: | 7-benzyl-2-{[(4-methoxyphenyl)methyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 525.69 |
| Molecular Formula: | C30 H27 N3 O2 S2 |
| Smiles: | COc1ccc(CSC2=Nc3c(C(N2c2ccccc2)=O)c2CCN(Cc4ccccc4)Cc2s3)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5974 |
| logD: | 5.5963 |
| logSw: | -5.4997 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36 |
| InChI Key: | JHPFTYUOSWZHFM-UHFFFAOYSA-N |