2-benzyl-N-[2-(4-benzylpiperazin-1-yl)ethyl]-1,3-benzoxazole-6-carboxamide
Chemical Structure Depiction of
2-benzyl-N-[2-(4-benzylpiperazin-1-yl)ethyl]-1,3-benzoxazole-6-carboxamide
2-benzyl-N-[2-(4-benzylpiperazin-1-yl)ethyl]-1,3-benzoxazole-6-carboxamide
Compound characteristics
Compound ID: | G706-0950 |
Compound Name: | 2-benzyl-N-[2-(4-benzylpiperazin-1-yl)ethyl]-1,3-benzoxazole-6-carboxamide |
Molecular Weight: | 454.57 |
Molecular Formula: | C28 H30 N4 O2 |
Smiles: | C(c1ccccc1)c1nc2ccc(cc2o1)C(NCCN1CCN(CC1)Cc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 3.9343 |
logD: | 3.7958 |
logSw: | -4.239 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 48.492 |
InChI Key: | GSJZYDDPDXBZAZ-UHFFFAOYSA-N |