7-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Chemical Structure Depiction of
7-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
7-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione
Compound characteristics
| Compound ID: | L462-0435 |
| Compound Name: | 7-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-1H-pyrrolo[2,3-d]pyrimidine-2,4(3H,7H)-dione |
| Molecular Weight: | 409.49 |
| Molecular Formula: | C22 H27 N5 O3 |
| Smiles: | Cc1ccc(c(C)c1)N1CCN(CC1)C(Cn1ccc2C(N(C)C(N(C)c12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.875 |
| logD: | 2.8745 |
| logSw: | -3.2137 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.036 |
| InChI Key: | QNLWXSIETCMWJG-UHFFFAOYSA-N |