5-(azepane-1-sulfonyl)-1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridin-2(1H)-one
Chemical Structure Depiction of
5-(azepane-1-sulfonyl)-1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridin-2(1H)-one
5-(azepane-1-sulfonyl)-1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridin-2(1H)-one
Compound characteristics
| Compound ID: | P511-1630 |
| Compound Name: | 5-(azepane-1-sulfonyl)-1-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]pyridin-2(1H)-one |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C22 H27 N3 O5 S |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CN1C=C(C=CC1=O)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.822 |
| logD: | 1.822 |
| logSw: | -2.6474 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.8 |
| InChI Key: | ZSJCHPTWNBUWRJ-UHFFFAOYSA-N |