2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Chemical Structure Depiction of
2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | C728-0418 |
| Compound Name: | 2-[7-acetyl-3-(3-acetylphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl]-N-[2-(cyclohex-1-en-1-yl)ethyl]acetamide |
| Molecular Weight: | 548.66 |
| Molecular Formula: | C29 H32 N4 O5 S |
| Smiles: | CC(c1cccc(c1)N1C(c2c3CCN(Cc3sc2N(CC(NCCC2CCCCC=2)=O)C1=O)C(C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2246 |
| logD: | 2.2246 |
| logSw: | -2.8923 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.488 |
| InChI Key: | SWNPBMJBEQHUES-UHFFFAOYSA-N |