N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
Compound characteristics
| Compound ID: | F145-0519 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C24 H29 N3 O4 S |
| Smiles: | COc1ccc(CCNC(CCC2NC(c3c4CCCCCc4sc3N=2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.6936 |
| logD: | 2.693 |
| logSw: | -3.1832 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.628 |
| InChI Key: | ZXQZOKYGNJMPFO-UHFFFAOYSA-N |