1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene

C30H24Cl2S — CID 139947365

IUPAC1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene
SMILESClc1ccccc1C(/C=C\c1ccccc1)SC(/C=C\c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C30H24Cl2S/c31-27-17-9-7-15-25(27)29(21-19-23-11-3-1-4-12-23)33-30(26-16-8-10-18-28(26)32)22-20-24-13-5-2-6-14-24/h1-22,29-30H/b21-19-,22-20-
InChIKeyYFOZOLMDWDXFBW-WRBBJXAJSA-N
MW487.50 g/mol
LogP9.94
Rot. Bonds8

About 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene

1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene (PubChem CID 139947365) has the molecular formula C30H24Cl2S and a molecular weight of 487.50 g/mol. Its IUPAC name is 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene.

Molecular Properties

Compound Name1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene
PubChem CID139947365
Molecular FormulaC30H24Cl2S
Molecular Weight487.50 g/mol
Exact Mass486.10
IUPAC Name1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene
SMILESClc1ccccc1C(/C=C\c1ccccc1)SC(/C=C\c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C30H24Cl2S/c31-27-17-9-7-15-25(27)29(21-19-23-11-3-1-4-12-23)33-30(26-16-8-10-18-28(26)32)22-20-24-13-5-2-6-14-24/h1-22,29-30H/b21-19-,22-20-
InChIKeyYFOZOLMDWDXFBW-WRBBJXAJSA-N
XLogP9.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.50
LogP ≤ 59.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene 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 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene?
The IUPAC name of 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene (CID 139947365) is 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene.
What is the SMILES notation for 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene?
The canonical SMILES for 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene is Clc1ccccc1C(/C=C\c1ccccc1)SC(/C=C\c1ccccc1)c1ccccc1Cl.
What is the InChIKey of 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene?
The InChIKey is YFOZOLMDWDXFBW-WRBBJXAJSA-N. The full InChI is InChI=1S/C30H24Cl2S/c31-27-17-9-7-15-25(27)29(21-19-23-11-3-1-4-12-23)33-30(26-16-8-10-18-28(26)32)22-20-24-13-5-2-6-14-24/h1-22,29-30H/b21-19-,22-20-.
What are the key properties of 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene?
1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene has a molecular weight of 487.50 g/mol, XLogP of 9.94, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[(Z)-1-[(Z)-1-(2-chlorophenyl)-3-phenylprop-2-enyl]sulfanyl-3-phenylprop-2-enyl]benzene is sourced from PubChem (CID 139947365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).