3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine

C19H17ClN6O2S — CID 46913527

IUPAC3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine
SMILESCN(C)S(=O)(=O)Nc1cc(-c2cnc3cc(-c4ccncc4)ccn23)cnc1Cl
InChIInChI=1S/C19H17ClN6O2S/c1-25(2)29(27,28)24-16-9-15(11-23-19(16)20)17-12-22-18-10-14(5-8-26(17)18)13-3-6-21-7-4-13/h3-12,24H,1-2H3
InChIKeyYOIZUFBQTNCUSR-UHFFFAOYSA-N
MW428.91 g/mol
LogP3.33
Rot. Bonds5

About 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine

3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine (PubChem CID 46913527) has the molecular formula C19H17ClN6O2S and a molecular weight of 428.91 g/mol. Its IUPAC name is 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine
PubChem CID46913527
Molecular FormulaC19H17ClN6O2S
Molecular Weight428.91 g/mol
Exact Mass428.08
IUPAC Name3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine
SMILESCN(C)S(=O)(=O)Nc1cc(-c2cnc3cc(-c4ccncc4)ccn23)cnc1Cl
InChIInChI=1S/C19H17ClN6O2S/c1-25(2)29(27,28)24-16-9-15(11-23-19(16)20)17-12-22-18-10-14(5-8-26(17)18)13-3-6-21-7-4-13/h3-12,24H,1-2H3
InChIKeyYOIZUFBQTNCUSR-UHFFFAOYSA-N
XLogP3.33
TPSA92.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.91
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine with MolForge

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Related Compounds

Glu-P 1
CID 49971
Bms-279700
CID 9844320
Imidazo[1,2-a]pyridine deriv. 1c
CID 6539020
Imidazo[1,2-a]pyridine deriv. 1d
CID 6539021
Imidazo[1,2-a]pyridine deriv. 1g
CID 6539023
6-chloro-9-[(4-chloro-3,5-dimethylpyridin-2-yl)methyl]-9H-purin-2-amine
CID 16736765
6-Chloro-9-(3,4,5-trimethyl-pyridin-2-ylmethyl)-9H-purin-2-ylamine
CID 16736767
Gsk1331258
CID 46190877
6-[4-[(6-Chloroimidazo[1,2-a]pyridin-2-yl)methyl]piperazin-1-yl]pyridine-3-carbonitrile
CID 73211886
4-(2-(4-Fluorophenyl)-7-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine
CID 9844057
N-(2-chloro-6-methylphenyl)-12-(4-methylpiperazin-1-yl)-2,4,8,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-7-amine
CID 9866128
4-(7-(1-Ethylpiperidin-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine
CID 10070518

Frequently Asked Questions

What is the IUPAC name of 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine?
The IUPAC name of 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine (CID 46913527) is 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine is CN(C)S(=O)(=O)Nc1cc(-c2cnc3cc(-c4ccncc4)ccn23)cnc1Cl.
What is the InChIKey of 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine?
The InChIKey is YOIZUFBQTNCUSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN6O2S/c1-25(2)29(27,28)24-16-9-15(11-23-19(16)20)17-12-22-18-10-14(5-8-26(17)18)13-3-6-21-7-4-13/h3-12,24H,1-2H3.
What are the key properties of 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine?
3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine has a molecular weight of 428.91 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-chloro-5-(dimethylsulfamoylamino)-3-pyridinyl]-7-pyridin-4-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 46913527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).