4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L309-1291 |
| Compound Name: | 4-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C20 H25 N5 O5 S |
| Smiles: | CN1CCN(CC1)S(c1ccc2c(c1)N(Cc1nc(C3CCC3)on1)C(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2221 |
| logD: | 1.1595 |
| logSw: | -2.5093 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 92.447 |
| InChI Key: | JTNBINCJKHLGEB-UHFFFAOYSA-N |