(4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole

C24H24N2 — CID 11442400

IUPAC(4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole
SMILESc1ccc(CCCC2=N[C@H](c3ccccc3)[C@H](c3ccccc3)N2)cc1
InChIInChI=1S/C24H24N2/c1-4-11-19(12-5-1)13-10-18-22-25-23(20-14-6-2-7-15-20)24(26-22)21-16-8-3-9-17-21/h1-9,11-12,14-17,23-24H,10,13,18H2,(H,25,26)/t23-,24+
InChIKeyQHHSXUAJGPXJIW-PSWAGMNNSA-N
MW340.47 g/mol
LogP5.49
Rot. Bonds6

About (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole

(4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole (PubChem CID 11442400) has the molecular formula C24H24N2 and a molecular weight of 340.47 g/mol. Its IUPAC name is (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name(4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole
PubChem CID11442400
Molecular FormulaC24H24N2
Molecular Weight340.47 g/mol
Exact Mass340.19
IUPAC Name(4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole
SMILESc1ccc(CCCC2=N[C@H](c3ccccc3)[C@H](c3ccccc3)N2)cc1
InChIInChI=1S/C24H24N2/c1-4-11-19(12-5-1)13-10-18-22-25-23(20-14-6-2-7-15-20)24(26-22)21-16-8-3-9-17-21/h1-9,11-12,14-17,23-24H,10,13,18H2,(H,25,26)/t23-,24+
InChIKeyQHHSXUAJGPXJIW-PSWAGMNNSA-N
XLogP5.49
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.47
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole?
The IUPAC name of (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole (CID 11442400) is (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole.
What is the SMILES notation for (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole?
The canonical SMILES for (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole is c1ccc(CCCC2=N[C@H](c3ccccc3)[C@H](c3ccccc3)N2)cc1.
What is the InChIKey of (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole?
The InChIKey is QHHSXUAJGPXJIW-PSWAGMNNSA-N. The full InChI is InChI=1S/C24H24N2/c1-4-11-19(12-5-1)13-10-18-22-25-23(20-14-6-2-7-15-20)24(26-22)21-16-8-3-9-17-21/h1-9,11-12,14-17,23-24H,10,13,18H2,(H,25,26)/t23-,24+.
What are the key properties of (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole?
(4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole has a molecular weight of 340.47 g/mol, XLogP of 5.49, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-4,5-diphenyl-2-(3-phenylpropyl)-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 11442400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).