N-[4-(azepane-1-sulfonyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[4-(azepane-1-sulfonyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide
N-[4-(azepane-1-sulfonyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y500-6438 |
| Compound Name: | N-[4-(azepane-1-sulfonyl)phenyl]-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C17 H22 N4 O3 S |
| Smiles: | Cn1ccc(C(Nc2ccc(cc2)S(N2CCCCCC2)(=O)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9448 |
| logD: | 1.942 |
| logSw: | -2.7413 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.064 |
| InChI Key: | XYDKYWNZWIPRJB-UHFFFAOYSA-N |