N-(3-chloro-4-methoxyphenyl)-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide
Compound characteristics
| Compound ID: | C258-0595 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetamide |
| Molecular Weight: | 524.04 |
| Molecular Formula: | C27 H26 Cl N3 O4 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c3CCCCc3sc2N(CC(Nc2ccc(c(c2)[Cl])OC)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9038 |
| logD: | 5.9037 |
| logSw: | -6.2723 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.807 |
| InChI Key: | NHXMOSOBSSNGGV-UHFFFAOYSA-N |