1-{2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}heptan-1-one
Chemical Structure Depiction of
1-{2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}heptan-1-one
1-{2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}heptan-1-one
Compound characteristics
| Compound ID: | V005-7851 |
| Compound Name: | 1-{2-[5-(3-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}heptan-1-one |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C25 H30 N2 O3 |
| Smiles: | CCCCCCC(N1CCCC1c1nc2cc(ccc2o1)c1cccc(c1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2553 |
| logD: | 6.2553 |
| logSw: | -5.3304 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.773 |
| InChI Key: | XIHLEBBNNHOYBD-QFIPXVFZSA-N |