6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L310-0469 |
| Compound Name: | 6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(pyrrolidine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 426.88 |
| Molecular Formula: | C17 H19 Cl N4 O5 S |
| Smiles: | CCc1nc(CN2C(COc3cc(c(cc23)[Cl])S(N2CCCC2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.0081 |
| logD: | 2.0081 |
| logSw: | -2.8708 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.75 |
| InChI Key: | JQDCWLPSIOYIOA-UHFFFAOYSA-N |