3-butyl-2-{[(2-methylphenyl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-butyl-2-{[(2-methylphenyl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-butyl-2-{[(2-methylphenyl)methyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0748 |
| Compound Name: | 3-butyl-2-{[(2-methylphenyl)methyl]sulfanyl}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: | CCCCN1C(=Nc2c3cccnc3sc2C1=O)SCc1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 5.7158 |
| logD: | 5.7158 |
| logSw: | -5.4183 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.921 |
| InChI Key: | VGUXDUGXUIYECZ-UHFFFAOYSA-N |