N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide

C15H11Cl2F2NOS — CID 55387332

IUPACN-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
SMILESCC(Sc1ccc(F)cc1F)C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2F2NOS/c1-8(22-13-6-5-9(18)7-11(13)19)15(21)20-12-4-2-3-10(16)14(12)17/h2-8H,1H3,(H,20,21)
InChIKeyCAHNQDHYJNPEDY-UHFFFAOYSA-N
MW362.23 g/mol
LogP5.39
Rot. Bonds4

About N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide

N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide (PubChem CID 55387332) has the molecular formula C15H11Cl2F2NOS and a molecular weight of 362.23 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
PubChem CID55387332
Molecular FormulaC15H11Cl2F2NOS
Molecular Weight362.23 g/mol
Exact Mass360.99
IUPAC NameN-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
SMILESCC(Sc1ccc(F)cc1F)C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C15H11Cl2F2NOS/c1-8(22-13-6-5-9(18)7-11(13)19)15(21)20-12-4-2-3-10(16)14(12)17/h2-8H,1H3,(H,20,21)
InChIKeyCAHNQDHYJNPEDY-UHFFFAOYSA-N
XLogP5.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.23
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide 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

(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
CID 8975147
(2R)-2-(2,4-difluorophenyl)sulfanyl-N-(2-methoxyphenyl)propanamide
CID 9046467
(2S)-2-(2,4-difluorophenyl)sulfanyl-N-(3-fluorophenyl)propanamide
CID 8975115
N-(2,3-dichlorophenyl)-2-phenylsulfanylpropanamide
CID 2955781
N-(3-aminophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
CID 43345469
(2S)-2-(2-chlorophenyl)sulfanyl-N-(2-fluorophenyl)propanamide
CID 2498847
(2R)-2-(2,5-difluorophenyl)sulfanyl-N-(2-fluorophenyl)propanamide
CID 8870293
N-(4-aminophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
CID 43345467
(2R)-2-(4-chlorophenyl)sulfanyl-N-(2,4-difluorophenyl)propanamide
CID 887088
1-(4-chlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropan-1-one
CID 43224788
N-(2,6-dichlorophenyl)-2-(2-fluorophenyl)sulfanylpropanamide
CID 78656452
N-(2,3-dichlorophenyl)-2-[[4-ethyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide
CID 112770622

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide (CID 55387332) is N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide is CC(Sc1ccc(F)cc1F)C(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
The InChIKey is CAHNQDHYJNPEDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2F2NOS/c1-8(22-13-6-5-9(18)7-11(13)19)15(21)20-12-4-2-3-10(16)14(12)17/h2-8H,1H3,(H,20,21).
What are the key properties of N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide has a molecular weight of 362.23 g/mol, XLogP of 5.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide is sourced from PubChem (CID 55387332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).