3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-phenyl-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-phenyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-phenyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F509-0040 |
| Compound Name: | 3-[2-(azepan-1-yl)-2-oxoethyl]-5,6-dimethyl-7-phenyl-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C22 H26 N4 O2 |
| Smiles: | Cc1c2C(N(CC(N3CCCCCC3)=O)C=Nc2n(c2ccccc2)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7029 |
| logD: | 2.7029 |
| logSw: | -2.8301 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.389 |
| InChI Key: | SCNUNIUCLZHWMG-UHFFFAOYSA-N |