N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluorobenzamide
N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | V025-3098 |
| Compound Name: | N-(butan-2-yl)-N-(3-{[5-(3-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluorobenzamide |
| Molecular Weight: | 460.96 |
| Molecular Formula: | C22 H22 Cl F N4 O2 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(CCC(Nc1nnc(c2cccc(c2)[Cl])s1)=O)C(c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.364 |
| logD: | 5.3637 |
| logSw: | -5.7908 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.179 |
| InChI Key: | UXNOPWWEOLRQMA-AWEZNQCLSA-N |