N-(3-chloro-4-fluorophenyl)-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
N-(3-chloro-4-fluorophenyl)-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-0553 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C18 H21 Cl F N3 O3 S |
| Smiles: | Cc1c(c(C)[nH]c1C(Nc1ccc(c(c1)[Cl])F)=O)S(N1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5146 |
| logD: | 3.071 |
| logSw: | -3.8962 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.022 |
| InChI Key: | XFRSQTAHYATNBY-UHFFFAOYSA-N |