About (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol
(2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol (PubChem CID 95128424) has the molecular formula C22H20N2O2
and a molecular weight of 344.41 g/mol. Its IUPAC name is (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol.
Molecular Properties
| Compound Name | (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol |
| PubChem CID | 95128424 |
| Molecular Formula | C22H20N2O2 |
| Molecular Weight | 344.41 g/mol |
| Exact Mass | 344.15 |
| IUPAC Name | (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol |
| SMILES | O[C@@H](Cc1ccccc1)Cn1cnc(-c2ccccc2)c1-c1ccco1 |
| InChI | InChI=1S/C22H20N2O2/c25-19(14-17-8-3-1-4-9-17)15-24-16-23-21(18-10-5-2-6-11-18)22(24)20-12-7-13-26-20/h1-13,16,19,25H,14-15H2/t19-/m0/s1 |
| InChIKey | WLBHOJMIUZDLFY-IBGZPJMESA-N |
| XLogP | 4.41 |
| TPSA | 51.19 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 344.41 |
| LogP ≤ 5 | 4.41 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol?
The IUPAC name of (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol (CID 95128424) is (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol.
What is the SMILES notation for (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol?
The canonical SMILES for (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol is O[C@@H](Cc1ccccc1)Cn1cnc(-c2ccccc2)c1-c1ccco1.
What is the InChIKey of (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol?
The InChIKey is WLBHOJMIUZDLFY-IBGZPJMESA-N. The full InChI is InChI=1S/C22H20N2O2/c25-19(14-17-8-3-1-4-9-17)15-24-16-23-21(18-10-5-2-6-11-18)22(24)20-12-7-13-26-20/h1-13,16,19,25H,14-15H2/t19-/m0/s1.
What are the key properties of (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol?
(2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol has a molecular weight of 344.41 g/mol, XLogP of 4.41, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[5-(furan-2-yl)-4-phenylimidazol-1-yl]-3-phenylpropan-2-ol is sourced from PubChem (CID 95128424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).