2-benzyl-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-1,3-benzoxazole-6-carboxamide
Chemical Structure Depiction of
2-benzyl-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-1,3-benzoxazole-6-carboxamide
2-benzyl-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-1,3-benzoxazole-6-carboxamide
Compound characteristics
Compound ID: | G706-0946 |
Compound Name: | 2-benzyl-N-{2-[4-(2-fluorophenyl)piperazin-1-yl]ethyl}-1,3-benzoxazole-6-carboxamide |
Molecular Weight: | 458.54 |
Molecular Formula: | C27 H27 F N4 O2 |
Smiles: | C(c1ccccc1)c1nc2ccc(cc2o1)C(NCCN1CCN(CC1)c1ccccc1F)=O |
Stereo: | ACHIRAL |
logP: | 4.4318 |
logD: | 4.422 |
logSw: | -4.4403 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.911 |
InChI Key: | ACEKOCGTIFYNII-UHFFFAOYSA-N |