5-(2,5-dimethylphenyl)-2-{[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(2,5-dimethylphenyl)-2-{[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(2,5-dimethylphenyl)-2-{[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V022-8625 |
| Compound Name: | 5-(2,5-dimethylphenyl)-2-{[(3-ethoxy-2-hydroxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C23 H31 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCOCC(CN(CC1NC(c2c(csc2N=1)c1cc(C)ccc1C)=O)C(C)C)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5484 |
| logD: | 3.5463 |
| logSw: | -3.9449 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.1 |
| InChI Key: | HFLPQRZPKPFWJN-KRWDZBQOSA-N |