N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide
Compound characteristics
| Compound ID: | C258-0481 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-[3-(4-ethylphenyl)-2,4-dioxo-3,4,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C27 H31 N3 O3 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c3CCCc3sc2N(CC(NCCC2CCCCC=2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7059 |
| logD: | 4.7059 |
| logSw: | -4.4288 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.899 |
| InChI Key: | AZPOCYPBSSDLGR-UHFFFAOYSA-N |