(4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole

C24H20N2O2S — CID 66560660

IUPAC(4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole
SMILESC(=C(C1=N[C@@H](c2ccccc2)CO1)C1=N[C@@H](c2ccccc2)CO1)c1cccs1
InChIInChI=1S/C24H20N2O2S/c1-3-8-17(9-4-1)21-15-27-23(25-21)20(14-19-12-7-13-29-19)24-26-22(16-28-24)18-10-5-2-6-11-18/h1-14,21-22H,15-16H2/t21-,22-/m1/s1
InChIKeyRJOVXINDCSPCEN-FGZHOGPDSA-N
MW400.50 g/mol
LogP5.47
Rot. Bonds5

About (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole

(4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole (PubChem CID 66560660) has the molecular formula C24H20N2O2S and a molecular weight of 400.50 g/mol. Its IUPAC name is (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name(4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole
PubChem CID66560660
Molecular FormulaC24H20N2O2S
Molecular Weight400.50 g/mol
Exact Mass400.12
IUPAC Name(4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole
SMILESC(=C(C1=N[C@@H](c2ccccc2)CO1)C1=N[C@@H](c2ccccc2)CO1)c1cccs1
InChIInChI=1S/C24H20N2O2S/c1-3-8-17(9-4-1)21-15-27-23(25-21)20(14-19-12-7-13-29-19)24-26-22(16-28-24)18-10-5-2-6-11-18/h1-14,21-22H,15-16H2/t21-,22-/m1/s1
InChIKeyRJOVXINDCSPCEN-FGZHOGPDSA-N
XLogP5.47
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.50
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole?
The IUPAC name of (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole (CID 66560660) is (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole?
The canonical SMILES for (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole is C(=C(C1=N[C@@H](c2ccccc2)CO1)C1=N[C@@H](c2ccccc2)CO1)c1cccs1.
What is the InChIKey of (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole?
The InChIKey is RJOVXINDCSPCEN-FGZHOGPDSA-N. The full InChI is InChI=1S/C24H20N2O2S/c1-3-8-17(9-4-1)21-15-27-23(25-21)20(14-19-12-7-13-29-19)24-26-22(16-28-24)18-10-5-2-6-11-18/h1-14,21-22H,15-16H2/t21-,22-/m1/s1.
What are the key properties of (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole?
(4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole has a molecular weight of 400.50 g/mol, XLogP of 5.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-phenyl-2-[1-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-2-thiophen-2-ylethenyl]-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 66560660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).