2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-ethylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-ethylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-ethylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0476 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-3-[(4-ethylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 478.03 |
| Molecular Formula: | C25 H20 Cl N3 O S2 |
| Smiles: | CCc1ccc(CN2C(=Nc3c4cccnc4sc3C2=O)SCc2ccc(cc2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5019 |
| logD: | 6.5019 |
| logSw: | -6.2733 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.672 |
| InChI Key: | UMHSIBAKGKCYEH-UHFFFAOYSA-N |