ethyl 4-{[7-(4-fluorophenyl)-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[7-(4-fluorophenyl)-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}benzoate
ethyl 4-{[7-(4-fluorophenyl)-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}benzoate
Compound characteristics
| Compound ID: | F254-3469 |
| Compound Name: | ethyl 4-{[7-(4-fluorophenyl)-2,5,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}benzoate |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C24 H23 F N4 O2 |
| Smiles: | CCOC(c1ccc(cc1)Nc1c2c(C)c(C)n(c3ccc(cc3)F)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6946 |
| logD: | 4.7255 |
| logSw: | -5.7902 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.531 |
| InChI Key: | RKBXKDYHFWCLQY-UHFFFAOYSA-N |