1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methoxyphenyl)methyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methoxyphenyl)methyl]piperidine-3-carboxamide
1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methoxyphenyl)methyl]piperidine-3-carboxamide
Compound characteristics
Compound ID: | F184-0458 |
Compound Name: | 1-(6-chloro-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-[(4-methoxyphenyl)methyl]piperidine-3-carboxamide |
Molecular Weight: | 493.97 |
Molecular Formula: | C22 H24 Cl N3 O6 S |
Smiles: | COc1ccc(CNC(C2CCCN(C2)S(c2cc3c(cc2[Cl])NC(CO3)=O)(=O)=O)=O)cc1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.6217 |
logD: | 1.5631 |
logSw: | -2.9729 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 97.11 |
InChI Key: | DIRMVCZGALSVPL-HNNXBMFYSA-N |