2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-phenylethyl)acetamide
2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-phenylethyl)acetamide
Compound characteristics
Compound ID: | C700-1138 |
Compound Name: | 2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]-N-(2-phenylethyl)acetamide |
Molecular Weight: | 485.6 |
Molecular Formula: | C25 H31 N3 O5 S |
Smiles: | CC1CC(C)CN(C1)S(c1ccc2c(c1)N(CC(NCCc1ccccc1)=O)C(CO2)=O)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.8864 |
logD: | 2.8864 |
logSw: | -3.6232 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.959 |
InChI Key: | CAQZULHJAJNDOO-UHFFFAOYSA-N |