About 1-(2-phenoxyphenyl)-3-phenylurea
1-(2-phenoxyphenyl)-3-phenylurea (PubChem CID 735813) has the molecular formula C19H16N2O2
and a molecular weight of 304.35 g/mol. Its IUPAC name is 1-(2-phenoxyphenyl)-3-phenylurea.
Molecular Properties
| Compound Name | 1-(2-phenoxyphenyl)-3-phenylurea |
| PubChem CID | 735813 |
| Molecular Formula | C19H16N2O2 |
| Molecular Weight | 304.35 g/mol |
| Exact Mass | 304.12 |
| IUPAC Name | 1-(2-phenoxyphenyl)-3-phenylurea |
| SMILES | O=C(Nc1ccccc1)Nc1ccccc1Oc1ccccc1 |
| InChI | InChI=1S/C19H16N2O2/c22-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)23-16-11-5-2-6-12-16/h1-14H,(H2,20,21,22) |
| InChIKey | LXHSHYBTKORIMO-UHFFFAOYSA-N |
| XLogP | 5.12 |
| TPSA | 50.36 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 304.35 |
| LogP ≤ 5 | 5.12 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-phenoxyphenyl)-3-phenylurea?
The IUPAC name of 1-(2-phenoxyphenyl)-3-phenylurea (CID 735813) is 1-(2-phenoxyphenyl)-3-phenylurea.
What is the SMILES notation for 1-(2-phenoxyphenyl)-3-phenylurea?
The canonical SMILES for 1-(2-phenoxyphenyl)-3-phenylurea is O=C(Nc1ccccc1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 1-(2-phenoxyphenyl)-3-phenylurea?
The InChIKey is LXHSHYBTKORIMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c22-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)23-16-11-5-2-6-12-16/h1-14H,(H2,20,21,22).
What are the key properties of 1-(2-phenoxyphenyl)-3-phenylurea?
1-(2-phenoxyphenyl)-3-phenylurea has a molecular weight of 304.35 g/mol, XLogP of 5.12, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenoxyphenyl)-3-phenylurea is sourced from PubChem (CID 735813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).