N~1~-[2-methyl-1-(octylamino)-1-oxopropan-2-yl]-N~2~-octylbenzene-1,2-dicarboxamide
Chemical Structure Depiction of
N~1~-[2-methyl-1-(octylamino)-1-oxopropan-2-yl]-N~2~-octylbenzene-1,2-dicarboxamide
N~1~-[2-methyl-1-(octylamino)-1-oxopropan-2-yl]-N~2~-octylbenzene-1,2-dicarboxamide
Compound characteristics
Compound ID: | K784-2587 |
Compound Name: | N~1~-[2-methyl-1-(octylamino)-1-oxopropan-2-yl]-N~2~-octylbenzene-1,2-dicarboxamide |
Molecular Weight: | 473.7 |
Molecular Formula: | C28 H47 N3 O3 |
Smiles: | CCCCCCCCNC(c1ccccc1C(NC(C)(C)C(NCCCCCCCC)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 6.65 |
logD: | 6.65 |
logSw: | -5.8373 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 72.989 |
InChI Key: | PTCQCEGWFVTKHR-UHFFFAOYSA-N |