2-{[benzyl(3-tert-butoxy-2-hydroxypropyl)amino]methyl}-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[benzyl(3-tert-butoxy-2-hydroxypropyl)amino]methyl}-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
2-{[benzyl(3-tert-butoxy-2-hydroxypropyl)amino]methyl}-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V017-7469 |
| Compound Name: | 2-{[benzyl(3-tert-butoxy-2-hydroxypropyl)amino]methyl}-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 505.68 |
| Molecular Formula: | C29 H35 N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)c1csc2c1C(NC(CN(CC(COC(C)(C)C)O)Cc1ccccc1)=N2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7379 |
| logD: | 5.7377 |
| logSw: | -5.4755 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.847 |
| InChI Key: | IZAVUFIHELYDMJ-QHCPKHFHSA-N |