N-(2-cyano-4,5-diethoxyphenyl)-3-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(2-cyano-4,5-diethoxyphenyl)-3-(pyrrolidine-1-sulfonyl)benzamide
N-(2-cyano-4,5-diethoxyphenyl)-3-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 8014-9828 |
| Compound Name: | N-(2-cyano-4,5-diethoxyphenyl)-3-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | CCOc1cc(C#N)c(cc1OCC)NC(c1cccc(c1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4521 |
| logD: | 1.5134 |
| logSw: | -3.1205 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.186 |
| InChI Key: | MRQQHYJHTLKJOV-UHFFFAOYSA-N |