N-{1-[3-(3,4,5-trimethoxyphenyl)propanoyl]piperidin-3-yl}but-2-ynamide
Chemical Structure Depiction of
N-{1-[3-(3,4,5-trimethoxyphenyl)propanoyl]piperidin-3-yl}but-2-ynamide
N-{1-[3-(3,4,5-trimethoxyphenyl)propanoyl]piperidin-3-yl}but-2-ynamide
Compound characteristics
| Compound ID: | T002-2840 |
| Compound Name: | N-{1-[3-(3,4,5-trimethoxyphenyl)propanoyl]piperidin-3-yl}but-2-ynamide |
| Molecular Weight: | 388.46 |
| Molecular Formula: | C21 H28 N2 O5 |
| Smiles: | CC#CC(NC1CCCN(C1)C(CCc1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0485 |
| logD: | 2.0485 |
| logSw: | -2.6422 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.275 |
| InChI Key: | IINRHRQUJVOLAR-INIZCTEOSA-N |