3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine

C25H18N2OS — CID 122186251

IUPAC3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine
SMILESNc1ncc(-c2ccccc2)c2scc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C25H18N2OS/c26-25-23-22(16-29-24(23)21(15-27-25)17-7-3-1-4-8-17)18-11-13-20(14-12-18)28-19-9-5-2-6-10-19/h1-16H,(H2,26,27)
InChIKeyUMDMXVONRZGSHM-UHFFFAOYSA-N
MW394.50 g/mol
LogP7.00
Rot. Bonds4

About 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine

3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine (PubChem CID 122186251) has the molecular formula C25H18N2OS and a molecular weight of 394.50 g/mol. Its IUPAC name is 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine
PubChem CID122186251
Molecular FormulaC25H18N2OS
Molecular Weight394.50 g/mol
Exact Mass394.11
IUPAC Name3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine
SMILESNc1ncc(-c2ccccc2)c2scc(-c3ccc(Oc4ccccc4)cc3)c12
InChIInChI=1S/C25H18N2OS/c26-25-23-22(16-29-24(23)21(15-27-25)17-7-3-1-4-8-17)18-11-13-20(14-12-18)28-19-9-5-2-6-10-19/h1-16H,(H2,26,27)
InChIKeyUMDMXVONRZGSHM-UHFFFAOYSA-N
XLogP7.00
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.50
LogP ≤ 57.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-{3-[4-Amino-7-(3-pyridinyl)thieno[3,2-c]pyridin-3-yl]phenyl}-N'-{4-[(phenylmethyl)oxy]phenyl}urea
CID 16224102
7-(Furan-2-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
CID 18450866
4-[4-amino-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-7-yl]-N,N-dimethylpyrazole-1-sulfonamide
CID 122186262
1-[4-[4-Amino-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-7-yl]pyrazol-1-yl]ethanone
CID 122186263
2-[4-[4-Amino-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-7-yl]pyrazol-1-yl]-1-piperidin-1-ylethanone
CID 122188509
3-(4-Phenoxyphenyl)-7-(1,2,3,6-tetrahydropyridin-4-yl)thieno[3,2-c]pyridin-4-amine
CID 122188633
7-(1-Methylpyrazol-4-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
CID 122186256
7-(1-Ethylpyrazol-4-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
CID 122186257
7-(1-Butylpyrazol-4-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
CID 122186258
7-(1-Benzylpyrazol-4-yl)-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
CID 122186259
7-[1-(3-Methoxypropyl)pyrazol-4-yl]-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-4-amine
CID 122186260
1-[4-[4-Amino-3-(4-phenoxyphenyl)thieno[3,2-c]pyridin-7-yl]pyrazol-1-yl]propan-2-one
CID 122188512

Frequently Asked Questions

What is the IUPAC name of 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine?
The IUPAC name of 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine (CID 122186251) is 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine?
The canonical SMILES for 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine is Nc1ncc(-c2ccccc2)c2scc(-c3ccc(Oc4ccccc4)cc3)c12.
What is the InChIKey of 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine?
The InChIKey is UMDMXVONRZGSHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2OS/c26-25-23-22(16-29-24(23)21(15-27-25)17-7-3-1-4-8-17)18-11-13-20(14-12-18)28-19-9-5-2-6-10-19/h1-16H,(H2,26,27).
What are the key properties of 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine?
3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine has a molecular weight of 394.50 g/mol, XLogP of 7.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-phenoxyphenyl)-7-phenylthieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 122186251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).