5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V016-9155 |
| Compound Name: | 5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-2-phenylethyl)(3-methoxypropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C27 H31 N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(c1)c1csc2c1C(NC(CN(CCCOC)CC(c1ccccc1)O)=N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1038 |
| logD: | 4.1036 |
| logSw: | -4.1987 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.987 |
| InChI Key: | FBRILTWMENABIQ-QHCPKHFHSA-N |