5-{[(5-chloro-2-methylphenyl)carbamamido]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(5-chloro-2-methylphenyl)carbamamido]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(5-chloro-2-methylphenyl)carbamamido]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L062-0117 |
Compound Name: | 5-{[(5-chloro-2-methylphenyl)carbamamido]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 415.9 |
Molecular Formula: | C19 H18 Cl N5 O2 S |
Smiles: | Cc1ccc(cc1)NC(c1nnc(CNC(Nc2cc(ccc2C)[Cl])=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 3.7376 |
logD: | 3.7376 |
logSw: | -4.2735 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 80.256 |
InChI Key: | MQUDNZDZDRDJIJ-UHFFFAOYSA-N |