N-[(3,4-diethoxyphenyl)methyl]-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-[(3,4-diethoxyphenyl)methyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide
N-[(3,4-diethoxyphenyl)methyl]-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: | F145-0988 |
| Compound Name: | N-[(3,4-diethoxyphenyl)methyl]-3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)propanamide |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C25 H31 N3 O4 S |
| Smiles: | CCOc1ccc(CNC(CCC2NC(c3c4CCCCCc4sc3N=2)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.5079 |
| logD: | 3.5073 |
| logSw: | -4.0113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.946 |
| InChI Key: | WOUWXDZITBJTTQ-UHFFFAOYSA-N |