(3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone

C19H11Cl2N3O2 — CID 134833710

IUPAC(3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone
SMILESO=C(c1cnc2c(c1)ncn2-c1ccccc1)c1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C19H11Cl2N3O2/c20-12-7-14(18(26)15(21)8-12)17(25)11-6-16-19(22-9-11)24(10-23-16)13-4-2-1-3-5-13/h1-10,26H
InChIKeyKZGAXTAUOXULTJ-UHFFFAOYSA-N
MW384.22 g/mol
LogP4.66
Rot. Bonds3

About (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone

(3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone (PubChem CID 134833710) has the molecular formula C19H11Cl2N3O2 and a molecular weight of 384.22 g/mol. Its IUPAC name is (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone.

Molecular Properties

Compound Name(3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone
PubChem CID134833710
Molecular FormulaC19H11Cl2N3O2
Molecular Weight384.22 g/mol
Exact Mass383.02
IUPAC Name(3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone
SMILESO=C(c1cnc2c(c1)ncn2-c1ccccc1)c1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C19H11Cl2N3O2/c20-12-7-14(18(26)15(21)8-12)17(25)11-6-16-19(22-9-11)24(10-23-16)13-4-2-1-3-5-13/h1-10,26H
InChIKeyKZGAXTAUOXULTJ-UHFFFAOYSA-N
XLogP4.66
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.22
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(5-chloro-2-hydroxyphenyl)(3-methyl-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)methanone
CID 1211939
[2-(3,5-Dichloro-2-hydroxybenzoyl)pyrido[1,2-a]benzimidazol-4-yl]-morpholin-4-ylmethanone
CID 3914832
2-(2-Hydroxy-5-methylbenzoyl)pyrido[1,2-a][1,3]benzimidazole-4-carbonitrile
CID 1484504
US9550771, Example 16
CID 122529855
6-(5-Fluoro-2-hydroxybenzoyl)-2-phenylimidazo[1,2-a]pyridine-8-carbonitrile
CID 135032505
6-(5-Fluoro-2-hydroxybenzoyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridine-8-carbonitrile
CID 135032508
2-(4-Chlorophenyl)-6-(5-fluoro-2-hydroxybenzoyl)imidazo[1,2-a]pyridine-8-carbonitrile
CID 135032509
2-(2-Hydroxybenzoyl)pyrido[1,2-a]benzimidazole-4-carbonitrile
CID 1484499
(3,5-Dichloro-2-hydroxyphenyl)-(2,3-dimethylimidazo[4,5-b]pyridin-6-yl)methanone
CID 125511267
(2-Hydroxyphenyl)-(2-methylsulfanyl-3-phenylimidazo[4,5-b]pyridin-6-yl)methanone
CID 134833519
(4,7-Dichloropyrido[1,2-a]benzimidazol-2-yl)-(2-hydroxyphenyl)methanone
CID 4838227
4-Chloro-2-{2-phenylpyrazolo[1,5-A]pyrimidine-6-carbonyl}phenol
CID 46502870

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone?
The IUPAC name of (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone (CID 134833710) is (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone.
What is the SMILES notation for (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone?
The canonical SMILES for (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone is O=C(c1cnc2c(c1)ncn2-c1ccccc1)c1cc(Cl)cc(Cl)c1O.
What is the InChIKey of (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone?
The InChIKey is KZGAXTAUOXULTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl2N3O2/c20-12-7-14(18(26)15(21)8-12)17(25)11-6-16-19(22-9-11)24(10-23-16)13-4-2-1-3-5-13/h1-10,26H.
What are the key properties of (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone?
(3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone has a molecular weight of 384.22 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-2-hydroxyphenyl)-(3-phenylimidazo[4,5-b]pyridin-6-yl)methanone is sourced from PubChem (CID 134833710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).