N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | C700-0291 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-carboxamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C25 H28 N2 O5 S |
| Smiles: | COc1ccc(cc1)S(Cc1ccc(C(NCCCN2CCc3ccccc3C2)=O)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2238 |
| logD: | 2.074 |
| logSw: | -3.6156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.287 |
| InChI Key: | RBSYAGFGZNAWCQ-UHFFFAOYSA-N |