7-acetyl-3-(4-ethoxyphenyl)-2-[(2-methylpropyl)sulfanyl]-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-[(2-methylpropyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
7-acetyl-3-(4-ethoxyphenyl)-2-[(2-methylpropyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-3551 |
| Compound Name: | 7-acetyl-3-(4-ethoxyphenyl)-2-[(2-methylpropyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 457.61 |
| Molecular Formula: | C23 H27 N3 O3 S2 |
| Smiles: | CCOc1ccc(cc1)N1C(=Nc2c(C1=O)c1CCN(Cc1s2)C(C)=O)SCC(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.2516 |
| logD: | 4.2516 |
| logSw: | -4.2125 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.507 |
| InChI Key: | UPQDGNXVIWBBOJ-UHFFFAOYSA-N |