4-[(5-methyl-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-methyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L309-0112 |
| Compound Name: | 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-6-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 407.45 |
| Molecular Formula: | C17 H21 N5 O5 S |
| Smiles: | Cc1nc(CN2C(COc3ccc(cc23)S(N2CCN(C)CC2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 0.3515 |
| logD: | 0.2889 |
| logSw: | -2.335 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.423 |
| InChI Key: | MOXBAXLERLOEEP-UHFFFAOYSA-N |