4-butyl-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-butyl-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
4-butyl-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | V022-6598 |
| Compound Name: | 4-butyl-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide |
| Molecular Weight: | 607.17 |
| Molecular Formula: | C32 H35 Cl N4 O4 S |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)C(N(CCC(Nc1nnc(c2ccc(cc2)[Cl])s1)=O)CCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.677 |
| logD: | 6.6767 |
| logSw: | -6.38 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.818 |
| InChI Key: | KFEKQLURSWBPPV-UHFFFAOYSA-N |