N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hexyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hexyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hexyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide
Compound characteristics
| Compound ID: | V025-1031 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-hexyl-N-(3-{[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)benzamide |
| Molecular Weight: | 614.81 |
| Molecular Formula: | C35 H42 N4 O4 S |
| Smiles: | CCCCCCc1ccc(cc1)C(N(CCC(Nc1nnc(c2ccc(C)cc2)s1)=O)CCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5561 |
| logD: | 7.5558 |
| logSw: | -5.5059 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.818 |
| InChI Key: | DFFRKYZVXMHDSB-UHFFFAOYSA-N |