2-({ethyl[2-hydroxy-3-(2-methylpropoxy)propyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({ethyl[2-hydroxy-3-(2-methylpropoxy)propyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-({ethyl[2-hydroxy-3-(2-methylpropoxy)propyl]amino}methyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V022-9830 |
| Compound Name: | 2-({ethyl[2-hydroxy-3-(2-methylpropoxy)propyl]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 |
| Salt: | not_available |
| Smiles: | CCN(CC(COCC(C)C)O)CC1NC(c2c3CCCCc3sc2N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8912 |
| logD: | 2.8898 |
| logSw: | -3.1809 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.757 |
| InChI Key: | FLPOLZVABFRXAA-AWEZNQCLSA-N |