N~2~-[3-(azepan-1-yl)propyl]-N~5~-(4-fluorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-[3-(azepan-1-yl)propyl]-N~5~-(4-fluorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-[3-(azepan-1-yl)propyl]-N~5~-(4-fluorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
Compound ID: | G675-0885 |
Compound Name: | N~2~-[3-(azepan-1-yl)propyl]-N~5~-(4-fluorophenyl)-1,3,4-thiadiazole-2,5-dicarboxamide |
Molecular Weight: | 405.49 |
Molecular Formula: | C19 H24 F N5 O2 S |
Smiles: | C1CCCN(CC1)CCCNC(c1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.509 |
logD: | -0.0617 |
logSw: | -2.9362 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.402 |
InChI Key: | JAWQKYMKLCRZJP-UHFFFAOYSA-N |