3-benzyl-2-{[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-benzyl-2-{[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-benzyl-2-{[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0603 |
| Compound Name: | 3-benzyl-2-{[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl}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: | Cc1cc(C)c(cc1C)C(CSC1=Nc2c3cccnc3sc2C(N1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3743 |
| logD: | 6.3743 |
| logSw: | -5.6137 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.918 |
| InChI Key: | GEVAKCGQRDIVKY-UHFFFAOYSA-N |