(3RS)-6,7-dimethoxy-2-[3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
(3RS)-6,7-dimethoxy-2-[3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
(3RS)-6,7-dimethoxy-2-[3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | Y043-6225 |
| Compound Name: | (3RS)-6,7-dimethoxy-2-[3-(1H-pyrrol-1-yl)-3-(thiophen-3-yl)propanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C23 H25 N3 O4 S |
| Smiles: | COc1cc2C[C@@H](C(N)=O)N(Cc2cc1OC)C(CC(c1ccsc1)n1cccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.329 |
| logD: | 2.329 |
| logSw: | -2.8796 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.576 |
| InChI Key: | CLTIPNWMUFLWQO-GGYWPGCISA-N |