N~3~-[(benzyloxy)acetyl]-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]-N~3~-cyclohexyl-beta-alaninamide
Chemical Structure Depiction of
N~3~-[(benzyloxy)acetyl]-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]-N~3~-cyclohexyl-beta-alaninamide
N~3~-[(benzyloxy)acetyl]-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]-N~3~-cyclohexyl-beta-alaninamide
Compound characteristics
| Compound ID: | V026-6314 |
| Compound Name: | N~3~-[(benzyloxy)acetyl]-N-[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]-N~3~-cyclohexyl-beta-alaninamide |
| Molecular Weight: | 513.06 |
| Molecular Formula: | C26 H29 Cl N4 O3 S |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)N(CCC(Nc1nnc(c2cccc(c2)[Cl])s1)=O)C(COCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6891 |
| logD: | 5.6888 |
| logSw: | -5.8945 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.731 |
| InChI Key: | MBXBNTSWOGRNOD-UHFFFAOYSA-N |