N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)butanamide
Compound characteristics
| Compound ID: | V026-4194 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)butanamide |
| Molecular Weight: | 510.66 |
| Molecular Formula: | C27 H34 N4 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(N(CCC(Nc1nnc(c2ccc(C)cc2)s1)=O)CCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4976 |
| logD: | 4.4972 |
| logSw: | -4.2385 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.562 |
| InChI Key: | WVLOZGYRHGOKDA-UHFFFAOYSA-N |