2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0532 |
| Compound Name: | 2-{[(4-ethenylphenyl)methyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 485.63 |
| Molecular Formula: | C27 H23 N3 O2 S2 |
| Smiles: | CCOc1ccccc1CN1C(=Nc2c3cccnc3sc2C1=O)SCc1ccc(C=C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.911 |
| logD: | 5.911 |
| logSw: | -5.7051 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.882 |
| InChI Key: | RFXCNFZNSRQUGP-UHFFFAOYSA-N |