N-butyl-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethylpiperidine-4-carboxamide
Chemical Structure Depiction of
N-butyl-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethylpiperidine-4-carboxamide
N-butyl-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethylpiperidine-4-carboxamide
Compound characteristics
Compound ID: | F184-2722 |
Compound Name: | N-butyl-1-(2,6-dimethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-sulfonyl)-N-ethylpiperidine-4-carboxamide |
Molecular Weight: | 451.58 |
Molecular Formula: | C22 H33 N3 O5 S |
Smiles: | CCCCN(CC)C(C1CCN(CC1)S(c1cc2c(cc1C)NC(C(C)O2)=O)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.865 |
logD: | 2.8644 |
logSw: | -3.1479 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.744 |
InChI Key: | WIZLFFBIRHDKDJ-MRXNPFEDSA-N |