6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one

C20H16N2O2S — CID 143009072

IUPAC6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one
SMILESCOc1cc2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2s1
InChIInChI=1S/C20H16N2O2S/c1-24-19-12-16-17(23)13-18(21-14-8-4-2-5-9-14)22(20(16)25-19)15-10-6-3-7-11-15/h2-13,21H,1H3
InChIKeyMEFYAEUHUKPOCQ-UHFFFAOYSA-N
MW348.43 g/mol
LogP4.80
Rot. Bonds4

About 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one

6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one (PubChem CID 143009072) has the molecular formula C20H16N2O2S and a molecular weight of 348.43 g/mol. Its IUPAC name is 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one.

Molecular Properties

Compound Name6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one
PubChem CID143009072
Molecular FormulaC20H16N2O2S
Molecular Weight348.43 g/mol
Exact Mass348.09
IUPAC Name6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one
SMILESCOc1cc2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2s1
InChIInChI=1S/C20H16N2O2S/c1-24-19-12-16-17(23)13-18(21-14-8-4-2-5-9-14)22(20(16)25-19)15-10-6-3-7-11-15/h2-13,21H,1H3
InChIKeyMEFYAEUHUKPOCQ-UHFFFAOYSA-N
XLogP4.80
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-anilino-2-hydroxy-7-phenylthieno[2,3-b]pyridin-4-one
CID 143009081
2-anilino-1-phenyl-1,8-naphthyridin-4-one
CID 141067621
2-anilino-1-(3-methoxyphenyl)-1,7-naphthyridin-4-one
CID 58589526
6-anilino-7-methyl-4-oxothieno[2,3-b]pyridine-2-carbonitrile
CID 143009100
2-anilino-7-[(4-methoxyphenoxy)methyl]-1-phenyl-1,6-naphthyridin-4-one
CID 20790696
2-anilino-8-[(2-methylpropan-2-yl)oxy]-1-phenyl-1,6-naphthyridin-4-one
CID 20790507
2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide
CID 10155193
2,8-dianilino-1-phenyl-1,6-naphthyridin-4-one
CID 20790469
N-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)methanesulfonamide
CID 67564353
2-anilino-8-(phenoxymethyl)-1-phenyl-1,6-naphthyridin-4-one
CID 20790921
2-anilino-8-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-1,6-naphthyridin-4-one
CID 20790890
2-anilino-6-fluoro-1-phenyl-1,8-naphthyridin-4-one;ethyl formate
CID 174461645

Frequently Asked Questions

What is the IUPAC name of 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one?
The IUPAC name of 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one (CID 143009072) is 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one.
What is the SMILES notation for 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one?
The canonical SMILES for 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one is COc1cc2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2s1.
What is the InChIKey of 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one?
The InChIKey is MEFYAEUHUKPOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2S/c1-24-19-12-16-17(23)13-18(21-14-8-4-2-5-9-14)22(20(16)25-19)15-10-6-3-7-11-15/h2-13,21H,1H3.
What are the key properties of 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one?
6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one has a molecular weight of 348.43 g/mol, XLogP of 4.80, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-anilino-2-methoxy-7-phenylthieno[2,3-b]pyridin-4-one is sourced from PubChem (CID 143009072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).