N-ethyl-6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Chemical Structure Depiction of
N-ethyl-6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
N-ethyl-6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Compound characteristics
| Compound ID: | V009-5724 |
| Compound Name: | N-ethyl-6,7-dimethoxy-1-({[(propan-2-yl)carbamothioyl]amino}methyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide |
| Molecular Weight: | 410.6 |
| Molecular Formula: | C19 H30 N4 O2 S2 |
| Smiles: | CCNC(N1CCc2cc(c(cc2C1CNC(NC(C)C)=S)OC)OC)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3397 |
| logD: | 2.3397 |
| logSw: | -2.5908 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 47.528 |
| InChI Key: | DSKLTJGUUMWXQX-HNNXBMFYSA-N |