1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(2-methylphenyl)methyl]prolinamide
Chemical Structure Depiction of
1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(2-methylphenyl)methyl]prolinamide
1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(2-methylphenyl)methyl]prolinamide
Compound characteristics
| Compound ID: | F632-0246 |
| Compound Name: | 1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(2-methylphenyl)methyl]prolinamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | Cc1ccccc1CNC(C1CCCN1S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1451 |
| logD: | 2.1445 |
| logSw: | -2.7352 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.47 |
| InChI Key: | UCKMXWWOQOYLRZ-SFHVURJKSA-N |