N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C860-0770 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C26 H27 F N4 O3 S |
| Smiles: | COc1ccc(CCNC(C2CCN(CC2)c2c3c(c4c(cccc4s3)F)ncn2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.24 |
| logD: | 4.2031 |
| logSw: | -4.505 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.182 |
| InChI Key: | XCAKSFCEXLSSEB-UHFFFAOYSA-N |