2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide

C23H18F2N2O3 — CID 90119590

IUPAC2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide
SMILESNC(=O)CN1C(=O)OC(c2ccc(F)cc2)(c2ccc(F)cc2)[C@@H]1c1ccccc1
InChIInChI=1S/C23H18F2N2O3/c24-18-10-6-16(7-11-18)23(17-8-12-19(25)13-9-17)21(15-4-2-1-3-5-15)27(14-20(26)28)22(29)30-23/h1-13,21H,14H2,(H2,26,28)/t21-/m0/s1
InChIKeyONEZXVWCRQOWCI-NRFANRHFSA-N
MW408.40 g/mol
LogP3.89
Rot. Bonds5

About 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide

2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide (PubChem CID 90119590) has the molecular formula C23H18F2N2O3 and a molecular weight of 408.40 g/mol. Its IUPAC name is 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide.

Molecular Properties

Compound Name2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide
PubChem CID90119590
Molecular FormulaC23H18F2N2O3
Molecular Weight408.40 g/mol
Exact Mass408.13
IUPAC Name2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide
SMILESNC(=O)CN1C(=O)OC(c2ccc(F)cc2)(c2ccc(F)cc2)[C@@H]1c1ccccc1
InChIInChI=1S/C23H18F2N2O3/c24-18-10-6-16(7-11-18)23(17-8-12-19(25)13-9-17)21(15-4-2-1-3-5-15)27(14-20(26)28)22(29)30-23/h1-13,21H,14H2,(H2,26,28)/t21-/m0/s1
InChIKeyONEZXVWCRQOWCI-NRFANRHFSA-N
XLogP3.89
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
The IUPAC name of 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide (CID 90119590) is 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide.
What is the SMILES notation for 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
The canonical SMILES for 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide is NC(=O)CN1C(=O)OC(c2ccc(F)cc2)(c2ccc(F)cc2)[C@@H]1c1ccccc1.
What is the InChIKey of 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
The InChIKey is ONEZXVWCRQOWCI-NRFANRHFSA-N. The full InChI is InChI=1S/C23H18F2N2O3/c24-18-10-6-16(7-11-18)23(17-8-12-19(25)13-9-17)21(15-4-2-1-3-5-15)27(14-20(26)28)22(29)30-23/h1-13,21H,14H2,(H2,26,28)/t21-/m0/s1.
What are the key properties of 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide?
2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide has a molecular weight of 408.40 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4S)-5,5-bis(4-fluorophenyl)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]acetamide is sourced from PubChem (CID 90119590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).