2-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(pyrrolidine-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(pyrrolidine-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
2-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(pyrrolidine-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y042-2384 |
| Compound Name: | 2-(2,5-dimethyl-1H-pyrrol-1-yl)-1-[4-(pyrrolidine-1-sulfonyl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C17 H28 N4 O3 S |
| Smiles: | Cc1ccc(C)n1CC(N1CCCN(CC1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7366 |
| logD: | 0.7366 |
| logSw: | -2.0322 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.398 |
| InChI Key: | ISOWWBAZNQSPPH-UHFFFAOYSA-N |