4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | G243-1649 |
| Compound Name: | 4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 452.01 |
| Molecular Formula: | C22 H30 Cl N3 O3 S |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)c(c(C)n1C)S(NCCc1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3497 |
| logD: | 3.3494 |
| logSw: | -4.2495 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.597 |
| InChI Key: | YRXZGNPPJPXBFU-UHFFFAOYSA-N |