4-(azepane-1-sulfonyl)-N-(2,4-dimethylphenyl)-1-methyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(2,4-dimethylphenyl)-1-methyl-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-N-(2,4-dimethylphenyl)-1-methyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G636-2454 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(2,4-dimethylphenyl)-1-methyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C20 H27 N3 O3 S |
| Smiles: | Cc1ccc(c(C)c1)NC(c1cc(cn1C)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4845 |
| logD: | 3.4839 |
| logSw: | -3.6326 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.984 |
| InChI Key: | AOACDFFJWWPJBV-UHFFFAOYSA-N |