2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine

C19H18N2O4S — CID 24961513

IUPAC2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine
SMILESO=S(=O)(c1ccc(-c2ncc(-c3ccccc3)o2)cc1)C1CNCCO1
InChIInChI=1S/C19H18N2O4S/c22-26(23,18-13-20-10-11-24-18)16-8-6-15(7-9-16)19-21-12-17(25-19)14-4-2-1-3-5-14/h1-9,12,18,20H,10-11,13H2
InChIKeyQASUSHCFJDPULR-UHFFFAOYSA-N
MW370.43 g/mol
LogP2.73
Rot. Bonds4

About 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine

2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine (PubChem CID 24961513) has the molecular formula C19H18N2O4S and a molecular weight of 370.43 g/mol. Its IUPAC name is 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine.

Molecular Properties

Compound Name2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine
PubChem CID24961513
Molecular FormulaC19H18N2O4S
Molecular Weight370.43 g/mol
Exact Mass370.10
IUPAC Name2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine
SMILESO=S(=O)(c1ccc(-c2ncc(-c3ccccc3)o2)cc1)C1CNCCO1
InChIInChI=1S/C19H18N2O4S/c22-26(23,18-13-20-10-11-24-18)16-8-6-15(7-9-16)19-21-12-17(25-19)14-4-2-1-3-5-14/h1-9,12,18,20H,10-11,13H2
InChIKeyQASUSHCFJDPULR-UHFFFAOYSA-N
XLogP2.73
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine?
The IUPAC name of 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine (CID 24961513) is 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine.
What is the SMILES notation for 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine?
The canonical SMILES for 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine is O=S(=O)(c1ccc(-c2ncc(-c3ccccc3)o2)cc1)C1CNCCO1.
What is the InChIKey of 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine?
The InChIKey is QASUSHCFJDPULR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S/c22-26(23,18-13-20-10-11-24-18)16-8-6-15(7-9-16)19-21-12-17(25-19)14-4-2-1-3-5-14/h1-9,12,18,20H,10-11,13H2.
What are the key properties of 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine?
2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine has a molecular weight of 370.43 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine is sourced from PubChem (CID 24961513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).