1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(4-fluoro-2-methylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(4-fluoro-2-methylphenyl)piperidine-4-carboxamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(4-fluoro-2-methylphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-1354 |
| Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-(4-fluoro-2-methylphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 481.93 |
| Molecular Formula: | C21 H21 Cl F N3 O5 S |
| Smiles: | Cc1cc(ccc1NC(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 2.3517 |
| logD: | 2.2931 |
| logSw: | -3.2998 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.613 |
| InChI Key: | XGUDGWPKPSLAOS-UHFFFAOYSA-N |