2-(3-methoxyphenyl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]ethan-1-one
2-(3-methoxyphenyl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
Compound ID: | SA52-1104 |
Compound Name: | 2-(3-methoxyphenyl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]ethan-1-one |
Molecular Weight: | 386.49 |
Molecular Formula: | C21 H30 N4 O3 |
Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)C(Cc1cccc(c1)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.113 |
logD: | 3.0763 |
logSw: | -3.1876 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 59.129 |
InChI Key: | XAHJFBHJQOHYSW-IBGZPJMESA-N |