5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide

C19H14Cl3N3O4S — CID 69150759

IUPAC5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide
SMILESCc1cc(S(=O)(=O)Nc2ccc(Oc3cncc(Cl)c3)cc2C(N)=O)c(Cl)cc1Cl
InChIInChI=1S/C19H14Cl3N3O4S/c1-10-4-18(16(22)7-15(10)21)30(27,28)25-17-3-2-12(6-14(17)19(23)26)29-13-5-11(20)8-24-9-13/h2-9,25H,1H3,(H2,23,26)
InChIKeyDTAWZCUCVSXQHX-UHFFFAOYSA-N
MW486.76 g/mol
LogP5.04
Rot. Bonds6

About 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide

5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide (PubChem CID 69150759) has the molecular formula C19H14Cl3N3O4S and a molecular weight of 486.76 g/mol. Its IUPAC name is 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound Name5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide
PubChem CID69150759
Molecular FormulaC19H14Cl3N3O4S
Molecular Weight486.76 g/mol
Exact Mass484.98
IUPAC Name5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide
SMILESCc1cc(S(=O)(=O)Nc2ccc(Oc3cncc(Cl)c3)cc2C(N)=O)c(Cl)cc1Cl
InChIInChI=1S/C19H14Cl3N3O4S/c1-10-4-18(16(22)7-15(10)21)30(27,28)25-17-3-2-12(6-14(17)19(23)26)29-13-5-11(20)8-24-9-13/h2-9,25H,1H3,(H2,23,26)
InChIKeyDTAWZCUCVSXQHX-UHFFFAOYSA-N
XLogP5.04
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.76
LogP ≤ 55.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide with MolForge

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Related Compounds

N-[2-bromo-4-[(5-chloro-3-pyridinyl)oxy]-3-methylphenyl]-2,4-dichloro-5-methylbenzenesulfonamide
CID 23515232
2,4-dichloro-N-[2-[(5-chloro-3-pyridinyl)oxy]-5-methylphenyl]-5-methylbenzenesulfonamide
CID 21357756
5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichlorophenyl)sulfonylamino]-N-ethylbenzamide
CID 59066721
4-[4-[(5-chloro-3-pyridinyl)oxy]-2-pyridinyl]-2-methylbenzamide
CID 171537783
5-chloro-2-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide
CID 47077078
4-[(5-chloro-3-pyridinyl)oxy]-N'-hydroxy-2-methylbenzenecarboximidamide
CID 81277984
methyl 2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]-4,5-dimethoxybenzoate
CID 3459990
4-chloro-N-(4-methoxy-2-methylphenyl)-2,5-dimethylbenzenesulfonamide
CID 22202576
2-[(5-chloro-3-pyridinyl)oxy]-5-[(2,4-dichlorophenyl)sulfonylamino]-N-ethylbenzamide
CID 71525044
N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide
CID 11519607
4-chloro-N-(2,4-dimethoxyphenyl)-2,5-dimethylbenzenesulfonamide
CID 3783398
N-[4-[(5-chloro-3-pyridinyl)oxy]phenyl]-2-ethoxybenzenesulfonamide
CID 69201104

Frequently Asked Questions

What is the IUPAC name of 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide (CID 69150759) is 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide is Cc1cc(S(=O)(=O)Nc2ccc(Oc3cncc(Cl)c3)cc2C(N)=O)c(Cl)cc1Cl.
What is the InChIKey of 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide?
The InChIKey is DTAWZCUCVSXQHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl3N3O4S/c1-10-4-18(16(22)7-15(10)21)30(27,28)25-17-3-2-12(6-14(17)19(23)26)29-13-5-11(20)8-24-9-13/h2-9,25H,1H3,(H2,23,26).
What are the key properties of 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide?
5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide has a molecular weight of 486.76 g/mol, XLogP of 5.04, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-chloro-3-pyridinyl)oxy]-2-[(2,4-dichloro-5-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 69150759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).