2-(butylsulfanyl)-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(butylsulfanyl)-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-(butylsulfanyl)-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0693 |
| Compound Name: | 2-(butylsulfanyl)-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 395.54 |
| Molecular Formula: | C21 H21 N3 O S2 |
| Smiles: | CCCCSC1=Nc2c3cccnc3sc2C(N1Cc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7181 |
| logD: | 5.7181 |
| logSw: | -5.4306 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.943 |
| InChI Key: | RKWWGBAVIFOMQE-UHFFFAOYSA-N |