2-[(1,3-benzoxazol-2-yl)amino]-4-methyl-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-[(1,3-benzoxazol-2-yl)amino]-4-methyl-6-phenylpyrimidine-5-carbonitrile
2-[(1,3-benzoxazol-2-yl)amino]-4-methyl-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | 6359-0057 |
| Compound Name: | 2-[(1,3-benzoxazol-2-yl)amino]-4-methyl-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 327.34 |
| Molecular Formula: | C19 H13 N5 O |
| Smiles: | Cc1c(C#N)c(c2ccccc2)nc(Nc2nc3ccccc3o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2556 |
| logD: | 4.2542 |
| logSw: | -4.5039 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.383 |
| InChI Key: | XWOXWSUQMOGLCB-UHFFFAOYSA-N |