1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methylphenyl)methyl]prolinamide
Chemical Structure Depiction of
1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methylphenyl)methyl]prolinamide
1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methylphenyl)methyl]prolinamide
Compound characteristics
| Compound ID: | G851-1105 |
| Compound Name: | 1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methylphenyl)methyl]prolinamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | Cc1ccc(CNC(C2CCCN2S(c2cc3c(cc2C)NC(CO3)=O)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6805 |
| logD: | 1.68 |
| logSw: | -2.5941 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.47 |
| InChI Key: | JHDYKJSHPXXQJX-SFHVURJKSA-N |