5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxybutyl)(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxybutyl)(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxybutyl)(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V019-0919 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxybutyl)(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 459.61 |
| Molecular Formula: | C24 H33 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCC(CN(CCC(C)C)CC1NC(c2c(csc2N=1)c1ccc(c(c1)OC)OC)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7598 |
| logD: | 3.7579 |
| logSw: | -4.2441 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.645 |
| InChI Key: | HLLQHYRXKXUCEE-KRWDZBQOSA-N |