3-(azepane-1-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-7259 |
| Compound Name: | 3-(azepane-1-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C20 H28 N4 O5 S |
| Smiles: | Cn1cc(C(NCc2cc(ccc2OC)OC)=O)c(n1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3003 |
| logD: | 2.3003 |
| logSw: | -2.9828 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.998 |
| InChI Key: | FVSGILFXAVHCEV-UHFFFAOYSA-N |