N-[(4-methoxyphenyl)methyl]-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
N-[(4-methoxyphenyl)methyl]-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide
Compound characteristics
| Compound ID: | F822-0458 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)prolinamide |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C22 H25 N3 O6 S |
| Smiles: | CC1C(Nc2cc(ccc2O1)S(N1CCCC1C(NCc1ccc(cc1)OC)=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5822 |
| logD: | 1.5819 |
| logSw: | -2.5507 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.352 |
| InChI Key: | HBDXXXAGTOZKEF-UHFFFAOYSA-N |