6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(4-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Chemical Structure Depiction of
6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(4-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(4-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide
Compound characteristics
| Compound ID: | L310-0458 |
| Compound Name: | 6-chloro-4-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(4-methoxyphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonamide |
| Molecular Weight: | 492.94 |
| Molecular Formula: | C21 H21 Cl N4 O6 S |
| Smiles: | CCc1nc(CN2C(COc3cc(c(cc23)[Cl])S(NCc2ccc(cc2)OC)(=O)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.8995 |
| logD: | 2.8994 |
| logSw: | -3.5075 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.975 |
| InChI Key: | BCAVMDHTDNQORT-UHFFFAOYSA-N |