5-[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | G713-0383 |
Compound Name: | 5-[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]-N-(3-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 451.33 |
Molecular Formula: | C19 H16 Cl2 N4 O3 S |
Smiles: | COc1ccc(cc1NC(CCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.9236 |
logD: | 3.9166 |
logSw: | -4.3479 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.139 |
InChI Key: | PTBCMVZZFWEFHC-UHFFFAOYSA-N |