2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V031-1535 |
| Compound Name: | 2-[(4-acetylpiperazin-1-yl)methyl]-5-(2-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C20 H22 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)CC1NC(c2c(csc2N=1)c1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9367 |
| logD: | 1.9366 |
| logSw: | -2.7805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.731 |
| InChI Key: | AITGXJMVBQJXCQ-UHFFFAOYSA-N |