N-(4-chloro-2-methylphenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)prolinamide
Chemical Structure Depiction of
N-(4-chloro-2-methylphenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)prolinamide
N-(4-chloro-2-methylphenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)prolinamide
Compound characteristics
| Compound ID: | F632-0035 |
| Compound Name: | N-(4-chloro-2-methylphenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)prolinamide |
| Molecular Weight: | 463.94 |
| Molecular Formula: | C21 H22 Cl N3 O5 S |
| Smiles: | Cc1cc(ccc1NC(C1CCCN1S(c1cc2c(cc1C)NC(CO2)=O)(=O)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8158 |
| logD: | 2.8109 |
| logSw: | -3.5166 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.45 |
| InChI Key: | KPMQNPYCRAWEFN-KRWDZBQOSA-N |