7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine

C21H16N4OS — CID 146025713

IUPAC7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine
SMILESCc1cc(Oc2nccc3ccsc23)ccc1-c1c(C)ncc2nccn12
InChIInChI=1S/C21H16N4OS/c1-13-11-16(26-21-20-15(5-7-23-21)6-10-27-20)3-4-17(13)19-14(2)24-12-18-22-8-9-25(18)19/h3-12H,1-2H3
InChIKeyKJUJMQIFFDWSBH-UHFFFAOYSA-N
MW372.45 g/mol
LogP5.42
Rot. Bonds3

About 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine

7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine (PubChem CID 146025713) has the molecular formula C21H16N4OS and a molecular weight of 372.45 g/mol. Its IUPAC name is 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine.

Molecular Properties

Compound Name7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine
PubChem CID146025713
Molecular FormulaC21H16N4OS
Molecular Weight372.45 g/mol
Exact Mass372.10
IUPAC Name7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine
SMILESCc1cc(Oc2nccc3ccsc23)ccc1-c1c(C)ncc2nccn12
InChIInChI=1S/C21H16N4OS/c1-13-11-16(26-21-20-15(5-7-23-21)6-10-27-20)3-4-17(13)19-14(2)24-12-18-22-8-9-25(18)19/h3-12H,1-2H3
InChIKeyKJUJMQIFFDWSBH-UHFFFAOYSA-N
XLogP5.42
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.45
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-Methyl-5-(2-methyl-4-pyrrolo[1,2-a]pyrazin-1-yloxyphenyl)imidazo[1,2-a]pyrazine
CID 92044504
3-(4-Propan-2-yloxyphenyl)-6-(6-propan-2-yloxy-3-pyridinyl)imidazo[1,2-a]pyridine
CID 134179257
N-(2-aminoethyl)-4-(2-methoxyphenyl)-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093435
N-(2-aminoethyl)-4-(3-methoxyphenyl)-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093436
N-(2-aminoethyl)-4-(4-methoxyphenyl)-12-methyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 25093437
7-Methyl-2-[2-methyl-4-(3-piperidin-1-yl-propoxy)-phenyl]-imidazo[1,2-a]pyridine
CID 10270093
3-(3-(3-(Ethylsulfonyl)phenoxy)phenyl)-2-methyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 44137367
3-(3-(3-(Isopropylsulfonyl)phenoxy)phenyl)-2-methyl-8-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 46226318
5-[6-(2-methyl-4-pentan-3-yloxyphenyl)-2-pyrazin-2-ylpyrimidin-4-yl]-N-propyl-1,3-thiazol-2-amine
CID 58688642
US9670204, 82 N-(2-ethyl-6-(1-(methylsulfonyl)piperidin-4-yl)imidazo[1,2-a]pyridin-3-yl)-4-(4-methoxyphenyl)-N-methylthiazol-2-amine
CID 90446729
N-[(4-methoxyphenyl)methyl]-6-methyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-3-amine
CID 858049
4-[6-[(4-methoxyphenyl)methylsulfanyl]imidazo[1,2-a]pyridin-2-yl]-N,N-dimethylaniline
CID 17759060

Frequently Asked Questions

What is the IUPAC name of 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine?
The IUPAC name of 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine (CID 146025713) is 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine.
What is the SMILES notation for 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine?
The canonical SMILES for 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine is Cc1cc(Oc2nccc3ccsc23)ccc1-c1c(C)ncc2nccn12.
What is the InChIKey of 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine?
The InChIKey is KJUJMQIFFDWSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4OS/c1-13-11-16(26-21-20-15(5-7-23-21)6-10-27-20)3-4-17(13)19-14(2)24-12-18-22-8-9-25(18)19/h3-12H,1-2H3.
What are the key properties of 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine?
7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine has a molecular weight of 372.45 g/mol, XLogP of 5.42, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-methyl-4-(6-methylimidazo[1,2-a]pyrazin-5-yl)phenoxy]thieno[2,3-c]pyridine is sourced from PubChem (CID 146025713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).