5-[4-({[4-(dimethylamino)phenyl]methyl}amino)-4-oxobutyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[4-({[4-(dimethylamino)phenyl]methyl}amino)-4-oxobutyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[4-({[4-(dimethylamino)phenyl]methyl}amino)-4-oxobutyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0949 |
| Compound Name: | 5-[4-({[4-(dimethylamino)phenyl]methyl}amino)-4-oxobutyl]-N-(2-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C23 H27 N5 O2 S |
| Smiles: | Cc1ccccc1NC(c1nnc(CCCC(NCc2ccc(cc2)N(C)C)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9128 |
| logD: | 2.8973 |
| logSw: | -3.4082 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.636 |
| InChI Key: | BAXVOPDFUARWQS-UHFFFAOYSA-N |