N-(3,4-dimethylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
N-(3,4-dimethylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Compound characteristics
| Compound ID: | F822-0107 |
| Compound Name: | N-(3,4-dimethylphenyl)-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide |
| Molecular Weight: | 429.49 |
| Molecular Formula: | C21 H23 N3 O5 S |
| Smiles: | Cc1ccc(cc1C)NC(C1CCCN1S(c1ccc2c(c1)NC(CO2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4268 |
| logD: | 2.4266 |
| logSw: | -2.915 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.148 |
| InChI Key: | OKWKZRDVBDCSTO-SFHVURJKSA-N |