5-(2,4-dimethylphenyl)-2-{[(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(2,4-dimethylphenyl)-2-{[(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(2,4-dimethylphenyl)-2-{[(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V031-1578 |
| Compound Name: | 5-(2,4-dimethylphenyl)-2-{[(3-methylbutyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 355.5 |
| Molecular Formula: | C20 H25 N3 O S |
| Salt: | not_available |
| Smiles: | CC(C)CCNCC1NC(c2c(csc2N=1)c1ccc(C)cc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0432 |
| logD: | 3.9627 |
| logSw: | -4.2396 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.682 |
| InChI Key: | SRTRJQFVUIQPIU-UHFFFAOYSA-N |