2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-6001 |
| Compound Name: | 2-{3-[(2-chloro-4-fluorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 491.99 |
| Molecular Formula: | C25 H31 Cl F N3 O4 |
| Smiles: | CCOc1ccc(CCNC(CN2CCCN(Cc3ccc(cc3[Cl])F)C2=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 3.2456 |
| logD: | 3.2456 |
| logSw: | -3.5316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.976 |
| InChI Key: | YYBDLAWWAYSKAI-UHFFFAOYSA-N |