3-(azepane-1-sulfonyl)-N-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-N-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazole-4-carboxamide
3-(azepane-1-sulfonyl)-N-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | M461-8126 |
| Compound Name: | 3-(azepane-1-sulfonyl)-N-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C18 H23 Cl N4 O4 S |
| Smiles: | Cn1cc(C(Nc2ccc(c(c2)[Cl])OC)=O)c(n1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6472 |
| logD: | 2.5546 |
| logSw: | -3.5724 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.132 |
| InChI Key: | RGEPMLZFEGJPFT-UHFFFAOYSA-N |