N-(3-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-0149 |
| Compound Name: | N-(3-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C25 H22 N4 O3 S |
| Smiles: | Cc1ccc(CNC(c2cccc(c2)NC(c2nnc(COc3ccccc3)s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4722 |
| logD: | 4.4721 |
| logSw: | -4.2887 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.97 |
| InChI Key: | DDFWZMBQEPDPRG-UHFFFAOYSA-N |