2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide

C14H10Cl3NOS — CID 4001438

IUPAC2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
SMILESO=C(CSc1ccccc1Cl)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H10Cl3NOS/c15-9-4-1-2-7-12(9)20-8-13(19)18-11-6-3-5-10(16)14(11)17/h1-7H,8H2,(H,18,19)
InChIKeyHDQVSEFUKHCMJD-UHFFFAOYSA-N
MW346.67 g/mol
LogP5.38
Rot. Bonds4

About 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide

2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide (PubChem CID 4001438) has the molecular formula C14H10Cl3NOS and a molecular weight of 346.67 g/mol. Its IUPAC name is 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
PubChem CID4001438
Molecular FormulaC14H10Cl3NOS
Molecular Weight346.67 g/mol
Exact Mass344.95
IUPAC Name2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
SMILESO=C(CSc1ccccc1Cl)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H10Cl3NOS/c15-9-4-1-2-7-12(9)20-8-13(19)18-11-6-3-5-10(16)14(11)17/h1-7H,8H2,(H,18,19)
InChIKeyHDQVSEFUKHCMJD-UHFFFAOYSA-N
XLogP5.38
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.67
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-(2-chlorophenyl)sulfanylacetamide
CID 2498952
2-(2-chlorophenyl)sulfanyl-N-(2-cyanophenyl)acetamide
CID 2390775
2-(2-chlorophenyl)sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7761217
N-(2,3-dichlorophenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylbenzamide
CID 55345939
2-(2-chlorophenyl)sulfanyl-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 35358026
methyl 2-[[2-(2-chlorophenyl)sulfanylacetyl]amino]benzoate
CID 2554185
N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide
CID 2591754
2-(2-chlorophenyl)sulfanyl-N-(2-piperidin-1-ylphenyl)acetamide
CID 112789398
2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide
CID 2337984
2-(2-amino-5-bromophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
CID 79519414
N-(2,3-dichlorophenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide
CID 2341250
2-(2-chlorophenyl)sulfanyl-N-(2-methyl-3-nitrophenyl)acetamide
CID 2498766

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide (CID 4001438) is 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide is O=C(CSc1ccccc1Cl)Nc1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide?
The InChIKey is HDQVSEFUKHCMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3NOS/c15-9-4-1-2-7-12(9)20-8-13(19)18-11-6-3-5-10(16)14(11)17/h1-7H,8H2,(H,18,19).
What are the key properties of 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide?
2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide has a molecular weight of 346.67 g/mol, XLogP of 5.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide is sourced from PubChem (CID 4001438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).