3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-(4-methylphenyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-(4-methylphenyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-(4-methylphenyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F509-0215 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-(4-methylphenyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C23 H28 N4 O2 |
| Smiles: | Cc1ccc(cc1)n1c(C)c(C)c2C(N(CC(N3CCCCCC3)=O)C=Nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2479 |
| logD: | 3.2479 |
| logSw: | -3.3291 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.389 |
| InChI Key: | UWQRQJIAGCRTAN-UHFFFAOYSA-N |