N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide

C22H18ClN3O5S — CID 71462063

IUPACN-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide
SMILESCOc1ccc(OC)c(S(=O)(=O)Nc2cnc(Oc3cnc4ccccc4c3)c(Cl)c2)c1
InChIInChI=1S/C22H18ClN3O5S/c1-29-16-7-8-20(30-2)21(11-16)32(27,28)26-15-10-18(23)22(25-12-15)31-17-9-14-5-3-4-6-19(14)24-13-17/h3-13,26H,1-2H3
InChIKeyOJPLNBWAZSXJTJ-UHFFFAOYSA-N
MW471.92 g/mol
LogP4.89
Rot. Bonds7

About N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide

N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide (PubChem CID 71462063) has the molecular formula C22H18ClN3O5S and a molecular weight of 471.92 g/mol. Its IUPAC name is N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide
PubChem CID71462063
Molecular FormulaC22H18ClN3O5S
Molecular Weight471.92 g/mol
Exact Mass471.07
IUPAC NameN-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide
SMILESCOc1ccc(OC)c(S(=O)(=O)Nc2cnc(Oc3cnc4ccccc4c3)c(Cl)c2)c1
InChIInChI=1S/C22H18ClN3O5S/c1-29-16-7-8-20(30-2)21(11-16)32(27,28)26-15-10-18(23)22(25-12-15)31-17-9-14-5-3-4-6-19(14)24-13-17/h3-13,26H,1-2H3
InChIKeyOJPLNBWAZSXJTJ-UHFFFAOYSA-N
XLogP4.89
TPSA99.64 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.92
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide 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

4-chloro-N-(3,5-dichloro-4-quinolin-3-yloxyphenyl)-2-methylbenzenesulfonamide
CID 70250383
5-(furan-3-yl)-2-methoxy-N-quinolin-3-ylbenzenesulfonamide
CID 56684216
3,4-dimethoxy-N-quinolin-3-ylbenzenesulfonamide
CID 795443
2,5-dimethoxy-N-[6-(N-methylanilino)-3-pyridinyl]benzenesulfonamide
CID 113016532
3-chloro-5-methoxy-N-methyl-4-quinolin-3-yloxyaniline
CID 155171669
4-methoxy-N-(2-methoxyethyl)-3-(quinolin-3-ylsulfamoyl)benzamide
CID 56684183
2,5-dimethoxy-N-pyrimidin-2-ylbenzenesulfonamide
CID 19683567
N-cyclohexyl-4-methoxy-3-(quinolin-3-ylsulfamoyl)benzamide
CID 56684157
2,5-dimethoxy-N-(3-phenylmethoxyphenyl)benzenesulfonamide
CID 3770079
2,5-dimethoxy-N-[6-(2-methylanilino)-3-pyridinyl]benzenesulfonamide
CID 113016171
1-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-N-methylmethanamine
CID 107387718
N-(3-chloro-4-hydroxynaphthalen-1-yl)-2,5-dimethoxybenzenesulfonamide
CID 58565637

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide?
The IUPAC name of N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide (CID 71462063) is N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide.
What is the SMILES notation for N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide?
The canonical SMILES for N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide is COc1ccc(OC)c(S(=O)(=O)Nc2cnc(Oc3cnc4ccccc4c3)c(Cl)c2)c1.
What is the InChIKey of N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide?
The InChIKey is OJPLNBWAZSXJTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18ClN3O5S/c1-29-16-7-8-20(30-2)21(11-16)32(27,28)26-15-10-18(23)22(25-12-15)31-17-9-14-5-3-4-6-19(14)24-13-17/h3-13,26H,1-2H3.
What are the key properties of N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide?
N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide has a molecular weight of 471.92 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-6-quinolin-3-yloxy-3-pyridinyl)-2,5-dimethoxybenzenesulfonamide is sourced from PubChem (CID 71462063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).