N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F854-0506 |
Compound Name: | N-(3-{[(4-chlorophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 414.91 |
Molecular Formula: | C20 H19 Cl N4 O2 S |
Smiles: | CCCc1nnc(C(Nc2cccc(c2)C(NCc2ccc(cc2)[Cl])=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 4.3763 |
logD: | 4.3762 |
logSw: | -4.5825 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.742 |
InChI Key: | XORNQWGYMFQXOI-UHFFFAOYSA-N |