4-{[(4-nitrophenyl)methyl]sulfanyl}-6-phenylpyrimidine
Chemical Structure Depiction of
4-{[(4-nitrophenyl)methyl]sulfanyl}-6-phenylpyrimidine
4-{[(4-nitrophenyl)methyl]sulfanyl}-6-phenylpyrimidine
Compound characteristics
| Compound ID: | D306-0286 |
| Compound Name: | 4-{[(4-nitrophenyl)methyl]sulfanyl}-6-phenylpyrimidine |
| Molecular Weight: | 323.37 |
| Molecular Formula: | C17 H13 N3 O2 S |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Sc1cc(c2ccccc2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2714 |
| logD: | 4.2712 |
| logSw: | -4.4206 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.248 |
| InChI Key: | RCYZGTZJEHVYMQ-UHFFFAOYSA-N |