(3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one

C24H22N2O2 — CID 102184973

IUPAC(3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one
SMILESO=C1ON[C@@H](c2cc3ccc2CCc2ccc(cc2)CC3)N1c1ccccc1
InChIInChI=1S/C24H22N2O2/c27-24-26(21-4-2-1-3-5-21)23(25-28-24)22-16-19-11-10-17-6-8-18(9-7-17)12-14-20(22)15-13-19/h1-9,13,15-16,23,25H,10-12,14H2/t23-/m1/s1
InChIKeyARGFJSMRPCHYAY-HSZRJFAPSA-N
MW370.45 g/mol
LogP4.73
Rot. Bonds2

About (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one

(3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one (PubChem CID 102184973) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one.

Molecular Properties

Compound Name(3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one
PubChem CID102184973
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name(3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one
SMILESO=C1ON[C@@H](c2cc3ccc2CCc2ccc(cc2)CC3)N1c1ccccc1
InChIInChI=1S/C24H22N2O2/c27-24-26(21-4-2-1-3-5-21)23(25-28-24)22-16-19-11-10-17-6-8-18(9-7-17)12-14-20(22)15-13-19/h1-9,13,15-16,23,25H,10-12,14H2/t23-/m1/s1
InChIKeyARGFJSMRPCHYAY-HSZRJFAPSA-N
XLogP4.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one?
The IUPAC name of (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one (CID 102184973) is (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one.
What is the SMILES notation for (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one?
The canonical SMILES for (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one is O=C1ON[C@@H](c2cc3ccc2CCc2ccc(cc2)CC3)N1c1ccccc1.
What is the InChIKey of (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one?
The InChIKey is ARGFJSMRPCHYAY-HSZRJFAPSA-N. The full InChI is InChI=1S/C24H22N2O2/c27-24-26(21-4-2-1-3-5-21)23(25-28-24)22-16-19-11-10-17-6-8-18(9-7-17)12-14-20(22)15-13-19/h1-9,13,15-16,23,25H,10-12,14H2/t23-/m1/s1.
What are the key properties of (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one?
(3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one has a molecular weight of 370.45 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-4-phenyl-3-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1,2,4-oxadiazolidin-5-one is sourced from PubChem (CID 102184973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).