N-[(4-chlorophenyl)methyl]-1-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-1-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide
N-[(4-chlorophenyl)methyl]-1-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F633-0819 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-1-(2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 491.99 |
| Molecular Formula: | C23 H26 Cl N3 O5 S |
| Smiles: | CCC1C(Nc2cc(ccc2O1)S(N1CCC(CC1)C(NCc1ccc(cc1)[Cl])=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0299 |
| logD: | 3.0295 |
| logSw: | -3.6308 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.166 |
| InChI Key: | PEGMPOUYLGDTLF-HXUWFJFHSA-N |