(adamantan-1-yl)[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
(adamantan-1-yl)[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methanone
(adamantan-1-yl)[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | G680-0051 |
| Compound Name: | (adamantan-1-yl)[4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 419.59 |
| Molecular Formula: | C22 H33 N3 O3 S |
| Smiles: | Cc1c(c(C)n(C(C23CC4CC(CC(C4)C3)C2)=O)n1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7878 |
| logD: | 3.7878 |
| logSw: | -3.7803 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.928 |
| InChI Key: | GUPQRSRITPGXQA-UHFFFAOYSA-N |