2-[(4-acetylpiperazin-1-yl)methyl]-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[(4-acetylpiperazin-1-yl)methyl]-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
2-[(4-acetylpiperazin-1-yl)methyl]-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V031-1502 |
| Compound Name: | 2-[(4-acetylpiperazin-1-yl)methyl]-5-(3,4-dimethylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C21 H24 N4 O2 S |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)CC1NC(c2c(csc2N=1)c1ccc(C)c(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7524 |
| logD: | 2.7524 |
| logSw: | -3.2266 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.731 |
| InChI Key: | IQABFEPWZVFTDM-UHFFFAOYSA-N |