N-(butan-2-yl)-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide
N-(butan-2-yl)-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide
Compound characteristics
| Compound ID: | V024-8930 |
| Compound Name: | N-(butan-2-yl)-N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide |
| Molecular Weight: | 479.08 |
| Molecular Formula: | C24 H35 Cl N4 O2 S |
| Smiles: | CCC(C)N(CCC(Nc1nnc(c2ccc(cc2)[Cl])s1)=O)C(CC(C)CC(C)(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5466 |
| logD: | 6.5463 |
| logSw: | -6.3488 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.923 |
| InChI Key: | ZJPOGNWLZCOVEQ-UHFFFAOYSA-N |