N~2~-methyl-N-[3-(methylsulfanyl)phenyl]-N~2~-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)glycinamide
Chemical Structure Depiction of
N~2~-methyl-N-[3-(methylsulfanyl)phenyl]-N~2~-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)glycinamide
N~2~-methyl-N-[3-(methylsulfanyl)phenyl]-N~2~-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | G805-1084 |
| Compound Name: | N~2~-methyl-N-[3-(methylsulfanyl)phenyl]-N~2~-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)glycinamide |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C18 H19 N3 O5 S2 |
| Smiles: | CN(CC(Nc1cccc(c1)SC)=O)S(c1ccc2c(c1)NC(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9381 |
| logD: | 1.9378 |
| logSw: | -2.9832 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.222 |
| InChI Key: | FALGWXBGXLUVAH-UHFFFAOYSA-N |