2-{[{2-hydroxy-3-[(propan-2-yl)oxy]propyl}(propan-2-yl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[{2-hydroxy-3-[(propan-2-yl)oxy]propyl}(propan-2-yl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[{2-hydroxy-3-[(propan-2-yl)oxy]propyl}(propan-2-yl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V022-3043 |
| Compound Name: | 2-{[{2-hydroxy-3-[(propan-2-yl)oxy]propyl}(propan-2-yl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 393.55 |
| Molecular Formula: | C20 H31 N3 O3 S |
| Smiles: | CC(C)N(CC(COC(C)C)O)CC1NC(c2c3CCCCc3sc2N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7897 |
| logD: | 2.7872 |
| logSw: | -3.2012 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.516 |
| InChI Key: | CECFSXUYCYQOPY-AWEZNQCLSA-N |