4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-ethylpiperazine-1-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-ethylpiperazine-1-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one
4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-ethylpiperazine-1-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L310-2527 |
| Compound Name: | 4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-ethylpiperazine-1-sulfonyl)-6-methyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C20 H27 N5 O5 S |
| Smiles: | CCc1nc(CN2C(COc3cc(c(C)cc23)S(N2CCN(CC)CC2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 1.5112 |
| logD: | 1.4245 |
| logSw: | -2.0214 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.921 |
| InChI Key: | DVKHCRZHXXNBFL-UHFFFAOYSA-N |