N-(5-chloro-2,4-dimethoxyphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide
N-(5-chloro-2,4-dimethoxyphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F184-1207 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 544.41 |
| Molecular Formula: | C22 H23 Cl2 N3 O7 S |
| Smiles: | COc1cc(c(cc1NC(C1CCN(CC1)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 2.6316 |
| logD: | 2.573 |
| logSw: | -3.3892 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.874 |
| InChI Key: | LJVKZJSYCRGFNV-UHFFFAOYSA-N |