6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one

C24H18Cl2N4O — CID 10095226

IUPAC6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one
SMILESCc1ccccc1N1N=C(c2c(-c3ccc(Cl)cc3Cl)nc3ccccn23)CCC1=O
InChIInChI=1S/C24H18Cl2N4O/c1-15-6-2-3-7-20(15)30-22(31)12-11-19(28-30)24-23(17-10-9-16(25)14-18(17)26)27-21-8-4-5-13-29(21)24/h2-10,13-14H,11-12H2,1H3
InChIKeySTCQKKLGDWIFNP-UHFFFAOYSA-N
MW449.34 g/mol
LogP6.15
Rot. Bonds3

About 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one

6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one (PubChem CID 10095226) has the molecular formula C24H18Cl2N4O and a molecular weight of 449.34 g/mol. Its IUPAC name is 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one.

Molecular Properties

Compound Name6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one
PubChem CID10095226
Molecular FormulaC24H18Cl2N4O
Molecular Weight449.34 g/mol
Exact Mass448.09
IUPAC Name6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one
SMILESCc1ccccc1N1N=C(c2c(-c3ccc(Cl)cc3Cl)nc3ccccn23)CCC1=O
InChIInChI=1S/C24H18Cl2N4O/c1-15-6-2-3-7-20(15)30-22(31)12-11-19(28-30)24-23(17-10-9-16(25)14-18(17)26)27-21-8-4-5-13-29(21)24/h2-10,13-14H,11-12H2,1H3
InChIKeySTCQKKLGDWIFNP-UHFFFAOYSA-N
XLogP6.15
TPSA49.97 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.34
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dichlorophenyl)-3-methylimidazo[1,2-a]pyridine;ethane
CID 155716211
3-(1-chloroethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
CID 82029766
[3-(2,4-dichlorophenyl)-1-(2-methylphenyl)pyrazol-4-yl]methanol
CID 3708231
2-[[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]iminomethyl]phenol
CID 1237435
2-(2,5-dichlorophenyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 71281270
[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-(pyridin-2-ylamino)methanol
CID 68625206
1-[2-(2,4-dichlorophenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 39146113
6-chloro-3-(chloromethyl)-2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridine
CID 82029741
2-(2,4-dichlorophenyl)-6-methylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 36688047
N-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-1-[5-(2,5-dimethyl-3-nitrophenyl)furan-2-yl]methanimine
CID 555953
[1-(2,4-dichlorophenyl)imidazo[1,5-a]pyridin-3-yl]-pyrrolidin-1-ylmethanone
CID 134789556
3-(chloromethyl)-2-(2,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133026

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one?
The IUPAC name of 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one (CID 10095226) is 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one.
What is the SMILES notation for 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one?
The canonical SMILES for 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one is Cc1ccccc1N1N=C(c2c(-c3ccc(Cl)cc3Cl)nc3ccccn23)CCC1=O.
What is the InChIKey of 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one?
The InChIKey is STCQKKLGDWIFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18Cl2N4O/c1-15-6-2-3-7-20(15)30-22(31)12-11-19(28-30)24-23(17-10-9-16(25)14-18(17)26)27-21-8-4-5-13-29(21)24/h2-10,13-14H,11-12H2,1H3.
What are the key properties of 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one?
6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one has a molecular weight of 449.34 g/mol, XLogP of 6.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-(2-methylphenyl)-4,5-dihydropyridazin-3-one is sourced from PubChem (CID 10095226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).