2-[(1,3-benzoxazol-2-yl)amino]-4-(4-chlorophenyl)-6-methylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)amino]-4-(4-chlorophenyl)-6-methylpyrimidine-5-carbonitrile
2-[(1,3-benzoxazol-2-yl)amino]-4-(4-chlorophenyl)-6-methylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | Y020-0190 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)amino]-4-(4-chlorophenyl)-6-methylpyrimidine-5-carbonitrile |
| Molecular Weight: | 361.79 |
| Molecular Formula: | C19 H12 Cl N5 O |
| Smiles: | Cc1c(C#N)c(c2ccc(cc2)[Cl])nc(Nc2nc3ccccc3o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9553 |
| logD: | 4.954 |
| logSw: | -5.3569 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.383 |
| InChI Key: | CRNGMLGBTATPFF-UHFFFAOYSA-N |