4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine

C18H12N4OS2 — CID 66760713

IUPAC4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
SMILESCc1ncc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)s1
InChIInChI=1S/C18H12N4OS2/c1-9-21-7-16(25-9)12-5-22-18(19)17-11(12)4-14(23-17)13-8-24-15-6-20-3-2-10(13)15/h2-8H,1H3,(H2,19,22)
InChIKeyFJPOGNAHCZFDQR-UHFFFAOYSA-N
MW364.46 g/mol
LogP5.12
Rot. Bonds2

About 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine

4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine (PubChem CID 66760713) has the molecular formula C18H12N4OS2 and a molecular weight of 364.46 g/mol. Its IUPAC name is 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
PubChem CID66760713
Molecular FormulaC18H12N4OS2
Molecular Weight364.46 g/mol
Exact Mass364.05
IUPAC Name4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
SMILESCc1ncc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)s1
InChIInChI=1S/C18H12N4OS2/c1-9-21-7-16(25-9)12-5-22-18(19)17-11(12)4-14(23-17)13-8-24-15-6-20-3-2-10(13)15/h2-8H,1H3,(H2,19,22)
InChIKeyFJPOGNAHCZFDQR-UHFFFAOYSA-N
XLogP5.12
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.46
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The IUPAC name of 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine (CID 66760713) is 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The canonical SMILES for 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine is Cc1ncc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)s1.
What is the InChIKey of 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The InChIKey is FJPOGNAHCZFDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N4OS2/c1-9-21-7-16(25-9)12-5-22-18(19)17-11(12)4-14(23-17)13-8-24-15-6-20-3-2-10(13)15/h2-8H,1H3,(H2,19,22).
What are the key properties of 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine has a molecular weight of 364.46 g/mol, XLogP of 5.12, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-1,3-thiazol-5-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 66760713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).