1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(3-methoxyphenyl)methyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(3-methoxyphenyl)methyl]piperidine-3-carboxamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(3-methoxyphenyl)methyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F184-0529 |
| Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(3-methoxyphenyl)methyl]piperidine-3-carboxamide |
| Molecular Weight: | 493.97 |
| Molecular Formula: | C22 H24 Cl N3 O6 S |
| Smiles: | COc1cccc(CNC(C2CCCN(C2)S(c2cc3c(cc2[Cl])NC(CO3)=O)(=O)=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7366 |
| logD: | 1.678 |
| logSw: | -2.9749 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.11 |
| InChI Key: | GTDDHZYFDARVKZ-HNNXBMFYSA-N |