N-benzyl-N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N~2~-methylglycinamide
Chemical Structure Depiction of
N-benzyl-N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N~2~-methylglycinamide
N-benzyl-N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N~2~-methylglycinamide
Compound characteristics
| Compound ID: | K906-3947 |
| Compound Name: | N-benzyl-N~2~-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethyl-N~2~-methylglycinamide |
| Molecular Weight: | 451.93 |
| Molecular Formula: | C20 H22 Cl N3 O5 S |
| Smiles: | CCN(Cc1ccccc1)C(CN(C)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8389 |
| logD: | 1.7803 |
| logSw: | -2.9973 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.753 |
| InChI Key: | KQZHPAAGYNDQHL-UHFFFAOYSA-N |