N-(3,4-dimethylphenyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide
N-(3,4-dimethylphenyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide
Compound characteristics
Compound ID: | SA52-0196 |
Compound Name: | N-(3,4-dimethylphenyl)-3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepane-1-carboxamide |
Molecular Weight: | 385.51 |
Molecular Formula: | C21 H31 N5 O2 |
Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)C(Nc1ccc(C)c(C)c1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0868 |
logD: | 3.804 |
logSw: | -4.1246 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.934 |
InChI Key: | MVBXWVUUVVMXEC-IBGZPJMESA-N |