4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Chemical Structure Depiction of
4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide
Compound characteristics
| Compound ID: | L309-0343 |
| Compound Name: | 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonamide |
| Molecular Weight: | 428.47 |
| Molecular Formula: | C20 H20 N4 O5 S |
| Smiles: | Cc1cccc(CNS(c2ccc3c(c2)N(Cc2nc(C)on2)C(CO3)=O)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.6465 |
| logD: | 2.6463 |
| logSw: | -3.0456 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.994 |
| InChI Key: | IXQMFKIBTQHNRZ-UHFFFAOYSA-N |