N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide
Compound characteristics
Compound ID: | C700-1147 |
Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[6-(3,5-dimethylpiperidine-1-sulfonyl)-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl]acetamide |
Molecular Weight: | 543.64 |
Molecular Formula: | C27 H33 N3 O7 S |
Smiles: | CC1CC(C)CN(C1)S(c1ccc2c(c1)N(CC(NC(C)c1ccc3c(c1)OCCO3)=O)C(CO2)=O)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.6133 |
logD: | 2.6133 |
logSw: | -3.175 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 95.104 |
InChI Key: | MDZBCDORFFXABB-UHFFFAOYSA-N |