2-(4-chlorophenyl)iodanuidylthiophene

C10H7ClIS- — CID 6400143

IUPAC2-(4-chlorophenyl)iodanuidylthiophene
SMILESClc1ccc([I-]c2cccs2)cc1
InChIInChI=1S/C10H7ClIS/c11-8-3-5-9(6-4-8)12-10-2-1-7-13-10/h1-7H/q-1
InChIKeyAHIYJTMFBKHXNR-UHFFFAOYSA-N
MW321.59 g/mol
LogP0.53
Rot. Bonds2

About 2-(4-chlorophenyl)iodanuidylthiophene

2-(4-chlorophenyl)iodanuidylthiophene (PubChem CID 6400143) has the molecular formula C10H7ClIS- and a molecular weight of 321.59 g/mol. Its IUPAC name is 2-(4-chlorophenyl)iodanuidylthiophene.

Molecular Properties

Compound Name2-(4-chlorophenyl)iodanuidylthiophene
PubChem CID6400143
Molecular FormulaC10H7ClIS-
Molecular Weight321.59 g/mol
Exact Mass320.90
IUPAC Name2-(4-chlorophenyl)iodanuidylthiophene
SMILESClc1ccc([I-]c2cccs2)cc1
InChIInChI=1S/C10H7ClIS/c11-8-3-5-9(6-4-8)12-10-2-1-7-13-10/h1-7H/q-1
InChIKeyAHIYJTMFBKHXNR-UHFFFAOYSA-N
XLogP0.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.59
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-thiophen-2-yliodanuidylthiophene
CID 139891725
3-(4-chlorophenyl)-2-thiophen-2-ylthiophene
CID 172853479
azane;1,4-dichlorobenzene
CID 69330361
2-[(E)-1-(4-chlorophenyl)-4,4,4-trifluorobut-2-enyl]thiophene
CID 162535681
2-[2-(4-chlorophenyl)sulfanylethynyl]thiophene
CID 154719973
chloro(trithiophen-2-yl)phosphanium
CID 102332443
3-(4-chlorophenyl)-1-methyl-5-thiophen-2-ylpyrazole
CID 56998816
1,5-bis(4-chlorophenyl)-2,4-dithiophen-2-ylpenta-1,4-dien-3-one
CID 141329084
6-chloro-2-thiophen-2-yl-2,3-dihydro-1H-quinazolin-4-one
CID 47409940
2-[bis(4-chlorophenyl)methyl]-5-[[2,3-bis(dithiophen-2-ylmethylidene)cyclopropylidene]-thiophen-2-ylmethyl]thiophene
CID 102462682
(Z)-1-(4-chlorophenyl)-3-thiophen-2-ylprop-2-en-1-one
CID 92857757
(4-chlorophenyl)boronic acid;thiophene-2-carboxylic acid
CID 174850224

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)iodanuidylthiophene?
The IUPAC name of 2-(4-chlorophenyl)iodanuidylthiophene (CID 6400143) is 2-(4-chlorophenyl)iodanuidylthiophene.
What is the SMILES notation for 2-(4-chlorophenyl)iodanuidylthiophene?
The canonical SMILES for 2-(4-chlorophenyl)iodanuidylthiophene is Clc1ccc([I-]c2cccs2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)iodanuidylthiophene?
The InChIKey is AHIYJTMFBKHXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClIS/c11-8-3-5-9(6-4-8)12-10-2-1-7-13-10/h1-7H/q-1.
What are the key properties of 2-(4-chlorophenyl)iodanuidylthiophene?
2-(4-chlorophenyl)iodanuidylthiophene has a molecular weight of 321.59 g/mol, XLogP of 0.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)iodanuidylthiophene is sourced from PubChem (CID 6400143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).