7-acetyl-3-(4-ethoxyphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-acetyl-3-(4-ethoxyphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
7-acetyl-3-(4-ethoxyphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-3941 |
| Compound Name: | 7-acetyl-3-(4-ethoxyphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 471.64 |
| Molecular Formula: | C24 H29 N3 O3 S2 |
| Smiles: | CCCCCSC1=Nc2c(C(N1c1ccc(cc1)OCC)=O)c1CCN(Cc1s2)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1995 |
| logD: | 5.1995 |
| logSw: | -4.9341 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.507 |
| InChI Key: | JPRAQEGSBOVNCZ-UHFFFAOYSA-N |