N-[(4-ethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
N-[(4-ethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Compound characteristics
| Compound ID: | F822-0285 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C22 H25 N3 O6 S |
| Smiles: | CCOc1ccc(CNC(C2CCCN2S(c2ccc3c(c2)NC(CO3)=O)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4089 |
| logD: | 1.4087 |
| logSw: | -2.5759 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.593 |
| InChI Key: | KQFVPQCRYRLJLZ-IBGZPJMESA-N |