N-(3-chloro-4-fluorophenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
N-(3-chloro-4-fluorophenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F184-0160 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-1-(6-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 481.93 |
| Molecular Formula: | C21 H21 Cl F N3 O5 S |
| Smiles: | Cc1cc2c(cc1S(N1CCCC(C1)C(Nc1ccc(c(c1)[Cl])F)=O)(=O)=O)OCC(N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4212 |
| logD: | 2.2695 |
| logSw: | -3.3278 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.244 |
| InChI Key: | KBXTYCDNUDVTHT-ZDUSSCGKSA-N |