3-[(4-ethylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
3-[(4-ethylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
3-[(4-ethylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | C200-7466 |
| Compound Name: | 3-[(4-ethylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C18 H15 N3 O S2 |
| Smiles: | CCc1ccc(CN2C(c3c(c4cccnc4s3)NC2=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0484 |
| logD: | 4.0453 |
| logSw: | -3.8717 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.218 |
| InChI Key: | NKBPUTNYSODFSN-UHFFFAOYSA-N |