5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0025 |
| Compound Name: | 5-{[(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 465.89 |
| Molecular Formula: | C19 H17 Cl F N5 O4 S |
| Smiles: | COc1cc(c(cc1NC(NCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.185 |
| logD: | 3.1823 |
| logSw: | -3.6298 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.517 |
| InChI Key: | KXWMCGUABXACPB-UHFFFAOYSA-N |