(2-phenoxazin-10-ylphenyl)-phenylmethanone

C₂₅H₁₇NO₂ — CID 121420431

About (2-phenoxazin-10-ylphenyl)-phenylmethanone

(2-phenoxazin-10-ylphenyl)-phenylmethanone (PubChem CID 121420431) has the molecular formula C₂₅H₁₇NO₂ and a molecular weight of 363.42 g/mol. Its IUPAC name is (2-phenoxazin-10-ylphenyl)-phenylmethanone.

Molecular Properties

• Compound Name: (2-phenoxazin-10-ylphenyl)-phenylmethanone
• PubChem CID: 121420431
• Molecular Formula: C₂₅H₁₇NO₂
• Molecular Weight: 363.42 g/mol
• Exact Mass: 363.13
• IUPAC Name: (2-phenoxazin-10-ylphenyl)-phenylmethanone
• SMILES: O=C(c1ccccc1)c1ccccc1N1c2ccccc2Oc2ccccc21
• InChI: InChI=1S/C25H17NO2/c27-25(18-10-2-1-3-11-18)19-12-4-5-13-20(19)26-21-14-6-8-16-23(21)28-24-17-9-7-15-22(24)26/h1-17H
• InChIKey: WPDQDMCKEUPZAZ-UHFFFAOYSA-N
• XLogP: 6.49
• TPSA: 29.54 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	363.42
LogP ≤ 5	6.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of (2-phenoxazin-10-ylphenyl)-phenylmethanone?

The IUPAC name of (2-phenoxazin-10-ylphenyl)-phenylmethanone (CID 121420431) is (2-phenoxazin-10-ylphenyl)-phenylmethanone.

What is the SMILES notation for (2-phenoxazin-10-ylphenyl)-phenylmethanone?

The canonical SMILES for (2-phenoxazin-10-ylphenyl)-phenylmethanone is O=C(c1ccccc1)c1ccccc1N1c2ccccc2Oc2ccccc21.

What is the InChIKey of (2-phenoxazin-10-ylphenyl)-phenylmethanone?

The InChIKey is WPDQDMCKEUPZAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO2/c27-25(18-10-2-1-3-11-18)19-12-4-5-13-20(19)26-21-14-6-8-16-23(21)28-24-17-9-7-15-22(24)26/h1-17H.

What are the key properties of (2-phenoxazin-10-ylphenyl)-phenylmethanone?

(2-phenoxazin-10-ylphenyl)-phenylmethanone has a molecular weight of 363.42 g/mol, XLogP of 6.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for (2-phenoxazin-10-ylphenyl)-phenylmethanone is sourced from PubChem (CID 121420431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 121420431 — identifiers, structure, computed properties (public domain)

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