2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide

C14H12Cl2N2OS — CID 43305569

IUPAC2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide
SMILESNc1ccc(SCC(=O)Nc2cccc(Cl)c2)c(Cl)c1
InChIInChI=1S/C14H12Cl2N2OS/c15-9-2-1-3-11(6-9)18-14(19)8-20-13-5-4-10(17)7-12(13)16/h1-7H,8,17H2,(H,18,19)
InChIKeyDUAKVPDSPDMOJF-UHFFFAOYSA-N
MW327.24 g/mol
LogP4.31
Rot. Bonds4

About 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide

2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide (PubChem CID 43305569) has the molecular formula C14H12Cl2N2OS and a molecular weight of 327.24 g/mol. Its IUPAC name is 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide
PubChem CID43305569
Molecular FormulaC14H12Cl2N2OS
Molecular Weight327.24 g/mol
Exact Mass326.00
IUPAC Name2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide
SMILESNc1ccc(SCC(=O)Nc2cccc(Cl)c2)c(Cl)c1
InChIInChI=1S/C14H12Cl2N2OS/c15-9-2-1-3-11(6-9)18-14(19)8-20-13-5-4-10(17)7-12(13)16/h1-7H,8,17H2,(H,18,19)
InChIKeyDUAKVPDSPDMOJF-UHFFFAOYSA-N
XLogP4.31
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.24
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-amino-2-chlorophenyl)sulfanyl-N-(2,6-difluorophenyl)acetamide
CID 43305241
2-(2-amino-5-methylphenyl)sulfanyl-N-(3-chlorophenyl)acetamide
CID 79142033
N-(3-chlorophenyl)-2-naphthalen-1-ylsulfanylacetamide
CID 39922768
3-(4-amino-2-fluorophenyl)sulfanyl-N-(3-chlorophenyl)propanamide
CID 43303444
2-(5-amino-2-chlorophenyl)sulfanyl-N-(3,4-difluorophenyl)acetamide
CID 79128069
N-(3-chlorophenyl)-2-(2,3,4,5,6-pentafluorophenyl)sulfanylacetamide
CID 7467403
2-(4-amino-2-bromophenyl)sulfanyl-N-(3,4-dichlorophenyl)acetamide
CID 82838705
2-(4-amino-2-fluorophenyl)sulfanyl-N-(3,4-dichlorophenyl)acetamide
CID 43303534
N'-acetyl-2-(4-amino-2-chlorophenyl)sulfanylacetohydrazide
CID 43305113
2-(4-amino-2-fluorophenyl)sulfanyl-N-(2,6-dichlorophenyl)acetamide
CID 43303659
2-(4-amino-2-chlorophenyl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide
CID 43305339
2-(2-amino-4-chlorophenyl)sulfanyl-N-(2,6-dichlorophenyl)acetamide
CID 43251034

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide?
The IUPAC name of 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide (CID 43305569) is 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide.
What is the SMILES notation for 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide?
The canonical SMILES for 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide is Nc1ccc(SCC(=O)Nc2cccc(Cl)c2)c(Cl)c1.
What is the InChIKey of 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide?
The InChIKey is DUAKVPDSPDMOJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2OS/c15-9-2-1-3-11(6-9)18-14(19)8-20-13-5-4-10(17)7-12(13)16/h1-7H,8,17H2,(H,18,19).
What are the key properties of 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide?
2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide has a molecular weight of 327.24 g/mol, XLogP of 4.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2-chlorophenyl)sulfanyl-N-(3-chlorophenyl)acetamide is sourced from PubChem (CID 43305569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).