4-(2-chlorophenyl)-1-ethyl-6-[3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
4-(2-chlorophenyl)-1-ethyl-6-[3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
4-(2-chlorophenyl)-1-ethyl-6-[3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V017-5344 |
| Compound Name: | 4-(2-chlorophenyl)-1-ethyl-6-[3-methyl-1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 444.96 |
| Molecular Formula: | C23 H29 Cl N4 O3 |
| Smiles: | CCN1C2CN(C(C(C)C)C(N3CCCC3)=O)C(C=2C(c2ccccc2[Cl])NC1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.295 |
| logD: | 3.2792 |
| logSw: | -3.4678 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.874 |
| InChI Key: | GMPLIVBRUUUFSZ-UHFFFAOYSA-N |