methyl 2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]benzoate
methyl 2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]benzoate
Compound characteristics
| Compound ID: | 8017-9632 |
| Compound Name: | methyl 2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]benzoate |
| Molecular Weight: | 281.67 |
| Molecular Formula: | C12 H9 Cl F N3 O2 |
| Smiles: | COC(c1ccccc1Nc1c(cnc(n1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1103 |
| logD: | 3.11 |
| logSw: | -3.7387 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.093 |
| InChI Key: | ZXPVJLDONWLURZ-UHFFFAOYSA-N |