N-(2-chloro-4-methylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide
N-(2-chloro-4-methylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F821-0498 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-1-(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 477.97 |
| Molecular Formula: | C22 H24 Cl N3 O5 S |
| Smiles: | CC1C(Nc2cc(ccc2O1)S(N1CCCC(C1)C(Nc1ccc(C)cc1[Cl])=O)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0878 |
| logD: | 3.084 |
| logSw: | -3.442 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.885 |
| InChI Key: | PAMIJNQQXKPQQK-UHFFFAOYSA-N |