6,7-dimethoxy-N-(3-methylphenyl)-1-{[(thiophene-2-carbonyl)amino]methyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-N-(3-methylphenyl)-1-{[(thiophene-2-carbonyl)amino]methyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
6,7-dimethoxy-N-(3-methylphenyl)-1-{[(thiophene-2-carbonyl)amino]methyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide
Compound characteristics
| Compound ID: | V026-6646 |
| Compound Name: | 6,7-dimethoxy-N-(3-methylphenyl)-1-{[(thiophene-2-carbonyl)amino]methyl}-3,4-dihydroisoquinoline-2(1H)-carboxamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C25 H27 N3 O4 S |
| Smiles: | Cc1cccc(c1)NC(N1CCc2cc(c(cc2C1CNC(c1cccs1)=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5348 |
| logD: | 3.5348 |
| logSw: | -3.7052 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.599 |
| InChI Key: | PBHYRFNEYNVTRK-FQEVSTJZSA-N |