2-methyl-N-{4-[5-(2-methylprop-2-enoyl)-1H-benzimidazol-2-yl]phenyl}prop-2-enamide
Chemical Structure Depiction of
2-methyl-N-{4-[5-(2-methylprop-2-enoyl)-1H-benzimidazol-2-yl]phenyl}prop-2-enamide
2-methyl-N-{4-[5-(2-methylprop-2-enoyl)-1H-benzimidazol-2-yl]phenyl}prop-2-enamide
Compound characteristics
Compound ID: | 8006-9932 |
Compound Name: | 2-methyl-N-{4-[5-(2-methylprop-2-enoyl)-1H-benzimidazol-2-yl]phenyl}prop-2-enamide |
Molecular Weight: | 345.4 |
Molecular Formula: | C21 H19 N3 O2 |
Smiles: | CC(=C)C(c1ccc2c(c1)nc(c1ccc(cc1)NC(C(C)=C)=O)[nH]2)=O |
Stereo: | ACHIRAL |
logP: | 4.689 |
logD: | 4.6887 |
logSw: | -4.3729 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.359 |
InChI Key: | CWFWIHBAELDTDN-UHFFFAOYSA-N |