3-benzyl-2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-benzyl-2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0601 |
| Compound Name: | 3-benzyl-2-{[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C26 H21 N3 O4 S2 |
| Smiles: | COc1ccc(cc1OC)C(CSC1=Nc2c3cccnc3sc2C(N1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6385 |
| logD: | 4.6385 |
| logSw: | -4.534 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.179 |
| InChI Key: | KYYIEQZWVLIPFY-UHFFFAOYSA-N |