2-{[(3-nitrophenyl)methyl]sulfanyl}-4-phenoxy-6-phenylpyrimidine
Chemical Structure Depiction of
2-{[(3-nitrophenyl)methyl]sulfanyl}-4-phenoxy-6-phenylpyrimidine
2-{[(3-nitrophenyl)methyl]sulfanyl}-4-phenoxy-6-phenylpyrimidine
Compound characteristics
| Compound ID: | V011-6336 |
| Compound Name: | 2-{[(3-nitrophenyl)methyl]sulfanyl}-4-phenoxy-6-phenylpyrimidine |
| Molecular Weight: | 415.47 |
| Molecular Formula: | C23 H17 N3 O3 S |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)Sc1nc(cc(n1)Oc1ccccc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3941 |
| logD: | 6.3941 |
| logSw: | -6.3311 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.018 |
| InChI Key: | HUBTVWMCRUXOPY-UHFFFAOYSA-N |