6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-N-propyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-N-propyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-N-propyl-3,4-dihydroisoquinoline-2(1H)-carboxamide
Compound characteristics
| Compound ID: | V001-4007 |
| Compound Name: | 6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-N-propyl-3,4-dihydroisoquinoline-2(1H)-carboxamide |
| Molecular Weight: | 408.56 |
| Molecular Formula: | C20 H32 N4 O3 S |
| Smiles: | CCCNC(N1CCc2cc(c(cc2C1CNC(NC(C)C)=S)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6123 |
| logD: | 2.6123 |
| logSw: | -2.9903 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.314 |
| InChI Key: | GUBCDJFADXZSJY-INIZCTEOSA-N |