1-[(tert-butylcarbamamido)methyl]-N-(4-ethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Chemical Structure Depiction of
1-[(tert-butylcarbamamido)methyl]-N-(4-ethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
1-[(tert-butylcarbamamido)methyl]-N-(4-ethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Compound characteristics
| Compound ID: | V012-8097 |
| Compound Name: | 1-[(tert-butylcarbamamido)methyl]-N-(4-ethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C26 H36 N4 O5 |
| Smiles: | CCOc1ccc(cc1)NC(N1CCc2cc(c(cc2C1CNC(NC(C)(C)C)=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5915 |
| logD: | 3.5915 |
| logSw: | -3.669 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.333 |
| InChI Key: | PJRGTFSFKDBGAK-NRFANRHFSA-N |