N~2~-(3-chlorophenyl)-N~5~-{3-[cyclohexyl(methyl)amino]propyl}-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-(3-chlorophenyl)-N~5~-{3-[cyclohexyl(methyl)amino]propyl}-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-(3-chlorophenyl)-N~5~-{3-[cyclohexyl(methyl)amino]propyl}-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
Compound ID: | G675-1230 |
Compound Name: | N~2~-(3-chlorophenyl)-N~5~-{3-[cyclohexyl(methyl)amino]propyl}-1,3,4-thiadiazole-2,5-dicarboxamide |
Molecular Weight: | 435.97 |
Molecular Formula: | C20 H26 Cl N5 O2 S |
Smiles: | CN(CCCNC(c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O)C1CCCCC1 |
Stereo: | ACHIRAL |
logP: | 3.4848 |
logD: | 0.96 |
logSw: | -3.8478 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.126 |
InChI Key: | VFVAXWFHWMQLGV-UHFFFAOYSA-N |