6-chloro-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
6-chloro-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L310-0112 |
| Compound Name: | 6-chloro-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-7-(4-methylpiperazine-1-sulfonyl)-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 441.89 |
| Molecular Formula: | C17 H20 Cl N5 O5 S |
| Smiles: | Cc1nc(CN2C(COc3cc(c(cc23)[Cl])S(N2CCN(C)CC2)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 0.6487 |
| logD: | 0.586 |
| logSw: | -2.7344 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.423 |
| InChI Key: | XWSXBNRPLGOBIE-UHFFFAOYSA-N |