5-{[(2,3-dimethylphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2,3-dimethylphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(2,3-dimethylphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0009 |
| Compound Name: | 5-{[(2,3-dimethylphenyl)carbamamido]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C19 H18 F N5 O2 S |
| Smiles: | Cc1cccc(c1C)NC(NCc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5167 |
| logD: | 3.514 |
| logSw: | -3.7254 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.256 |
| InChI Key: | AUPUZXDRZBNAQV-UHFFFAOYSA-N |