N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide

C19H15Cl2N3O3S — CID 2564609

IUPACN-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1cccc(S(=O)(=O)NCc2cccnc2)c1
InChIInChI=1S/C19H15Cl2N3O3S/c20-17-7-6-15(10-18(17)21)24-19(25)14-4-1-5-16(9-14)28(26,27)23-12-13-3-2-8-22-11-13/h1-11,23H,12H2,(H,24,25)
InChIKeyCFQPOFALRDIOHO-UHFFFAOYSA-N
MW436.32 g/mol
LogP4.12
Rot. Bonds6

About N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide

N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide (PubChem CID 2564609) has the molecular formula C19H15Cl2N3O3S and a molecular weight of 436.32 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide
PubChem CID2564609
Molecular FormulaC19H15Cl2N3O3S
Molecular Weight436.32 g/mol
Exact Mass435.02
IUPAC NameN-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1cccc(S(=O)(=O)NCc2cccnc2)c1
InChIInChI=1S/C19H15Cl2N3O3S/c20-17-7-6-15(10-18(17)21)24-19(25)14-4-1-5-16(9-14)28(26,27)23-12-13-3-2-8-22-11-13/h1-11,23H,12H2,(H,24,25)
InChIKeyCFQPOFALRDIOHO-UHFFFAOYSA-N
XLogP4.12
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.32
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 109064872
3-(benzylsulfamoyl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide
CID 34424924
N-(3-cyanophenyl)-4-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 109060943
3-(pyridin-3-ylmethylsulfamoyl)-N-pyrrolidin-3-ylbenzamide
CID 77084633
3-(azepane-1-carbonyl)-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 109064852
3-(benzylsulfamoyl)-N-[3-(hydroxymethyl)phenyl]benzamide
CID 9300349
N-(3-methylphenyl)-3-[(3-methylphenyl)methylsulfamoyl]benzamide
CID 109064583
3-[(2-methylphenyl)methylsulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 109064543
4-[[[3-(prop-2-enoylamino)phenyl]sulfonylamino]methyl]-N-pyridin-3-ylbenzamide
CID 50912860
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 51162183
N-ethyl-N-phenyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide
CID 109064866
4-chloro-3-(pyridin-3-ylmethylsulfamoyl)benzoic acid
CID 2411456

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
The IUPAC name of N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide (CID 2564609) is N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1cccc(S(=O)(=O)NCc2cccnc2)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
The InChIKey is CFQPOFALRDIOHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O3S/c20-17-7-6-15(10-18(17)21)24-19(25)14-4-1-5-16(9-14)28(26,27)23-12-13-3-2-8-22-11-13/h1-11,23H,12H2,(H,24,25).
What are the key properties of N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide?
N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide has a molecular weight of 436.32 g/mol, XLogP of 4.12, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-3-(pyridin-3-ylmethylsulfamoyl)benzamide is sourced from PubChem (CID 2564609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).