6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one

C18H12Cl2N2O3 — CID 27015894

IUPAC6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one
SMILESCc1cc(=O)oc2cc(OCc3cn4cc(Cl)ccc4n3)c(Cl)cc12
InChIInChI=1S/C18H12Cl2N2O3/c1-10-4-18(23)25-15-6-16(14(20)5-13(10)15)24-9-12-8-22-7-11(19)2-3-17(22)21-12/h2-8H,9H2,1H3
InChIKeyYFPHRAYTWVNKTN-UHFFFAOYSA-N
MW375.21 g/mol
LogP4.63
Rot. Bonds3

About 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one

6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one (PubChem CID 27015894) has the molecular formula C18H12Cl2N2O3 and a molecular weight of 375.21 g/mol. Its IUPAC name is 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one.

Molecular Properties

Compound Name6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one
PubChem CID27015894
Molecular FormulaC18H12Cl2N2O3
Molecular Weight375.21 g/mol
Exact Mass374.02
IUPAC Name6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one
SMILESCc1cc(=O)oc2cc(OCc3cn4cc(Cl)ccc4n3)c(Cl)cc12
InChIInChI=1S/C18H12Cl2N2O3/c1-10-4-18(23)25-15-6-16(14(20)5-13(10)15)24-9-12-8-22-7-11(19)2-3-17(22)21-12/h2-8H,9H2,1H3
InChIKeyYFPHRAYTWVNKTN-UHFFFAOYSA-N
XLogP4.63
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.21
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 2-(4-methyl-2-oxochromen-7-yl)oxyacetate
CID 8858505
6-chloro-4-methyl-7-(1,2-thiazol-5-ylmethoxy)chromen-2-one
CID 166372173
6-chloro-4-methyl-7-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]chromen-2-one
CID 38896678
N-[4-[(6-chloro-4-methyl-2-oxochromen-7-yl)oxymethyl]-1,3-thiazol-2-yl]-N-ethylacetamide
CID 30766722
6-chloro-4-methyl-7-[[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]methoxy]chromen-2-one
CID 39527648
4-[(6-chloro-4-methyl-2-oxochromen-7-yl)oxymethyl]benzonitrile
CID 4825255
6-chloro-7-[(4-ethenylphenyl)methoxy]-4-methylchromen-2-one
CID 1332729
2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxyacetic acid
CID 782909
6-chloro-7-[[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]methoxy]-4-methylchromen-2-one
CID 38896838
6-chloro-7-[(4-chlorophenyl)methoxy]-4-ethylchromen-2-one
CID 23824130
ethyl 2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxyacetate
CID 782904
methyl 5-[(6-chloro-4-methyl-2-oxochromen-7-yl)oxymethyl]furan-2-carboxylate
CID 5124704

Frequently Asked Questions

What is the IUPAC name of 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one?
The IUPAC name of 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one (CID 27015894) is 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one.
What is the SMILES notation for 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one?
The canonical SMILES for 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one is Cc1cc(=O)oc2cc(OCc3cn4cc(Cl)ccc4n3)c(Cl)cc12.
What is the InChIKey of 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one?
The InChIKey is YFPHRAYTWVNKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl2N2O3/c1-10-4-18(23)25-15-6-16(14(20)5-13(10)15)24-9-12-8-22-7-11(19)2-3-17(22)21-12/h2-8H,9H2,1H3.
What are the key properties of 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one?
6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one has a molecular weight of 375.21 g/mol, XLogP of 4.63, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-7-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]-4-methylchromen-2-one is sourced from PubChem (CID 27015894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).