N-(butan-2-yl)-N-(3-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-(3-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide
N-(butan-2-yl)-N-(3-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide
Compound characteristics
| Compound ID: | V001-6763 |
| Compound Name: | N-(butan-2-yl)-N-(3-{[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-3,5,5-trimethylhexanamide |
| Molecular Weight: | 474.67 |
| Molecular Formula: | C25 H38 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(CCC(Nc1nnc(c2cccc(c2)OC)s1)=O)C(CC(C)CC(C)(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9948 |
| logD: | 5.9945 |
| logSw: | -5.4467 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.467 |
| InChI Key: | DIWJCIVHHWWAIZ-UHFFFAOYSA-N |