1-{4-[(1R)-5-(4-methoxyphenyl)-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbonyl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[(1R)-5-(4-methoxyphenyl)-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbonyl]piperidin-1-yl}ethan-1-one
1-{4-[(1R)-5-(4-methoxyphenyl)-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbonyl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | T973-0812 |
| Compound Name: | 1-{4-[(1R)-5-(4-methoxyphenyl)-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbonyl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C25 H30 N2 O3 |
| Smiles: | [H]C1Cc2c(cccc2[C@@H](C)N1C(C1CCN(CC1)C(C)=O)=O)c1ccc(cc1)OC |
| Stereo: | ABSOLUTE |
| logP: | 3.8795 |
| logD: | 3.8795 |
| logSw: | -3.9932 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.384 |
| InChI Key: | NCHXEOADXOETMM-QGZVFWFLSA-N |