8-(azepane-1-sulfonyl)-2-(3-methylbutyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
8-(azepane-1-sulfonyl)-2-(3-methylbutyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
8-(azepane-1-sulfonyl)-2-(3-methylbutyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | M113-0530 |
| Compound Name: | 8-(azepane-1-sulfonyl)-2-(3-methylbutyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 366.48 |
| Molecular Formula: | C17 H26 N4 O3 S |
| Smiles: | CC(C)CCN1C(N2C=CC=C(C2=N1)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8672 |
| logD: | 2.8672 |
| logSw: | -3.1361 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.593 |
| InChI Key: | HYNKXXDYHDFYSI-UHFFFAOYSA-N |