5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L062-0498 |
Compound Name: | 5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 447.9 |
Molecular Formula: | C19 H18 Cl N5 O4 S |
Smiles: | COc1cc(c(cc1NC(NCc1nnc(C(Nc2ccccc2)=O)s1)=O)[Cl])OC |
Stereo: | ACHIRAL |
logP: | 2.9642 |
logD: | 2.9635 |
logSw: | -3.584 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 95.517 |
InChI Key: | MPIDASMZLATKPA-UHFFFAOYSA-N |