4-(azepane-1-sulfonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
4-(azepane-1-sulfonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
4-(azepane-1-sulfonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-1723 |
| Compound Name: | 4-(azepane-1-sulfonyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C21 H27 N3 O5 S |
| Smiles: | Cc1c(c(C)[nH]c1C(Nc1ccc2c(c1)OCCO2)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.253 |
| logD: | 2.2497 |
| logSw: | -3.0253 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.176 |
| InChI Key: | RWJBADZBQRYJSW-UHFFFAOYSA-N |