N-(5-chloro-2-methylphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
N-(5-chloro-2-methylphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F184-0429 |
| Compound Name: | N-(5-chloro-2-methylphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 498.38 |
| Molecular Formula: | C21 H21 Cl2 N3 O5 S |
| Smiles: | Cc1ccc(cc1NC(C1CCCN(C1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7062 |
| logD: | 2.6476 |
| logSw: | -3.4922 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.546 |
| InChI Key: | VSJQABTUUYUQTJ-ZDUSSCGKSA-N |