4-(3-{2-[N-methyl(phenyl)carbamamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide
Chemical Structure Depiction of
4-(3-{2-[N-methyl(phenyl)carbamamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide
4-(3-{2-[N-methyl(phenyl)carbamamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide
Compound characteristics
Compound ID: | L453-0109 |
Compound Name: | 4-(3-{2-[N-methyl(phenyl)carbamamido]ethyl}-1,2,4-oxadiazol-5-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]benzamide |
Molecular Weight: | 491.59 |
Molecular Formula: | C26 H33 N7 O3 |
Smiles: | CN1CCN(CCNC(c2ccc(cc2)c2nc(CCN(C)C(Nc3ccccc3)=O)no2)=O)CC1 |
Stereo: | ACHIRAL |
logP: | 1.7167 |
logD: | 1.0492 |
logSw: | -2.1006 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89.57 |
InChI Key: | SGEJGWMRHNYPOJ-UHFFFAOYSA-N |