N-ethyl-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylphenyl)butanamide
Chemical Structure Depiction of
N-ethyl-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylphenyl)butanamide
N-ethyl-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylphenyl)butanamide
Compound characteristics
| Compound ID: | E667-1319 |
| Compound Name: | N-ethyl-3-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(3-methylphenyl)butanamide |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C22 H26 N2 O5 S |
| Smiles: | CCN(C(CC(C)S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8481 |
| logD: | 2.8479 |
| logSw: | -3.1726 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.101 |
| InChI Key: | NRTGTQCPYUXYEC-INIZCTEOSA-N |