3-(azepane-1-sulfonyl)-1-methyl-N-[3-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-1-methyl-N-[3-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-1-methyl-N-[3-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-8093 |
| Compound Name: | 3-(azepane-1-sulfonyl)-1-methyl-N-[3-(propan-2-yl)phenyl]-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C20 H28 N4 O3 S |
| Smiles: | CC(C)c1cccc(c1)NC(c1cn(C)nc1S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4863 |
| logD: | 3.4859 |
| logSw: | -3.606 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.502 |
| InChI Key: | GDNHEVFLWUTDAK-UHFFFAOYSA-N |