N~3~-cyclohexyl-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-cyclohexyl-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
N~3~-cyclohexyl-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide
Compound characteristics
| Compound ID: | V024-8912 |
| Compound Name: | N~3~-cyclohexyl-N~3~-[(4-methoxyphenyl)acetyl]-N-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-beta-alaninamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1nnc(NC(CCN(C2CCCCC2)C(Cc2ccc(cc2)OC)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.6908 |
| logD: | 5.6905 |
| logSw: | -5.2184 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.84 |
| InChI Key: | YWGCNLCCLFWHCJ-UHFFFAOYSA-N |