N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
Chemical Structure Depiction of
N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide
Compound characteristics
| Compound ID: | V024-4360 |
| Compound Name: | N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylbutanamide |
| Molecular Weight: | 531.07 |
| Molecular Formula: | C26 H31 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CCC(Nc1nnc(c2ccc(cc2)[Cl])s1)=O)CCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6689 |
| logD: | 4.6686 |
| logSw: | -4.8434 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.562 |
| InChI Key: | FERIHFZIIGBZFQ-UHFFFAOYSA-N |