N-{6-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-[(4-methoxyphenyl)carbamamido]-6-oxohexyl}-N'-phenylurea
Chemical Structure Depiction of
N-{6-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-[(4-methoxyphenyl)carbamamido]-6-oxohexyl}-N'-phenylurea
N-{6-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-[(4-methoxyphenyl)carbamamido]-6-oxohexyl}-N'-phenylurea
Compound characteristics
| Compound ID: | V001-7330 |
| Compound Name: | N-{6-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-[(4-methoxyphenyl)carbamamido]-6-oxohexyl}-N'-phenylurea |
| Molecular Weight: | 589.69 |
| Molecular Formula: | C32 H39 N5 O6 |
| Smiles: | COc1ccc(cc1)NC(NC(CCCCNC(Nc1ccccc1)=O)C(N1CCc2cc(c(cc2C1)OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.728 |
| logD: | 3.728 |
| logSw: | -4.0785 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 106.347 |
| InChI Key: | NGCNYSKZUSWHPO-MHZLTWQESA-N |