3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine

C58H40Br2Cl7N13O2S8 — CID 165000061

IUPAC3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine
SMILESCc1cc(NCc2nccs2)c2scc(Cl)c2n1.Clc1cc(NCc2ccco2)c2scc(Br)c2n1.Clc1cc(NCc2ccco2)c2scc(Cl)c2n1.Clc1cc(NCc2nccs2)c2scc(Br)c2n1.Clc1cc(NCc2nccs2)c2scc(Cl)c2n1
InChIInChI=1S/C12H8BrClN2OS.C12H8Cl2N2OS.C12H10ClN3S2.C11H7BrClN3S2.C11H7Cl2N3S2/c2*13-8-6-18-12-9(4-10(14)16-11(8)12)15-5-7-2-1-3-17-7;1-7-4-9(15-5-10-14-2-3-17-10)12-11(16-7)8(13)6-18-12;2*12-6-5-18-11-7(3-8(13)16-10(6)11)15-4-9-14-1-2-17-9/h2*1-4,6H,5H2,(H,15,16);2-4,6H,5H2,1H3,(H,15,16);2*1-3,5H,4H2,(H,15,16)
InChIKeyICXWMCGGIRGIQI-UHFFFAOYSA-N
MW1615.56 g/mol
LogP23.50
Rot. Bonds15

About 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine

3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine (PubChem CID 165000061) has the molecular formula C58H40Br2Cl7N13O2S8 and a molecular weight of 1615.56 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine
PubChem CID165000061
Molecular FormulaC58H40Br2Cl7N13O2S8
Molecular Weight1615.56 g/mol
Exact Mass1608.74
IUPAC Name3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine
SMILESCc1cc(NCc2nccs2)c2scc(Cl)c2n1.Clc1cc(NCc2ccco2)c2scc(Br)c2n1.Clc1cc(NCc2ccco2)c2scc(Cl)c2n1.Clc1cc(NCc2nccs2)c2scc(Br)c2n1.Clc1cc(NCc2nccs2)c2scc(Cl)c2n1
InChIInChI=1S/C12H8BrClN2OS.C12H8Cl2N2OS.C12H10ClN3S2.C11H7BrClN3S2.C11H7Cl2N3S2/c2*13-8-6-18-12-9(4-10(14)16-11(8)12)15-5-7-2-1-3-17-7;1-7-4-9(15-5-10-14-2-3-17-10)12-11(16-7)8(13)6-18-12;2*12-6-5-18-11-7(3-8(13)16-10(6)11)15-4-9-14-1-2-17-9/h2*1-4,6H,5H2,(H,15,16);2-4,6H,5H2,1H3,(H,15,16);2*1-3,5H,4H2,(H,15,16)
InChIKeyICXWMCGGIRGIQI-UHFFFAOYSA-N
XLogP23.50
TPSA189.55 Ų
H-Bond Donors5
H-Bond Acceptors23
Rotatable Bonds15
Heavy Atoms90
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001615.56
LogP ≤ 523.50
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine?
The IUPAC name of 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine (CID 165000061) is 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine.
What is the SMILES notation for 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine?
The canonical SMILES for 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine is Cc1cc(NCc2nccs2)c2scc(Cl)c2n1.Clc1cc(NCc2ccco2)c2scc(Br)c2n1.Clc1cc(NCc2ccco2)c2scc(Cl)c2n1.Clc1cc(NCc2nccs2)c2scc(Br)c2n1.Clc1cc(NCc2nccs2)c2scc(Cl)c2n1.
What is the InChIKey of 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine?
The InChIKey is ICXWMCGGIRGIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrClN2OS.C12H8Cl2N2OS.C12H10ClN3S2.C11H7BrClN3S2.C11H7Cl2N3S2/c2*13-8-6-18-12-9(4-10(14)16-11(8)12)15-5-7-2-1-3-17-7;1-7-4-9(15-5-10-14-2-3-17-10)12-11(16-7)8(13)6-18-12;2*12-6-5-18-11-7(3-8(13)16-10(6)11)15-4-9-14-1-2-17-9/h2*1-4,6H,5H2,(H,15,16);2-4,6H,5H2,1H3,(H,15,16);2*1-3,5H,4H2,(H,15,16).
What are the key properties of 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine?
3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine has a molecular weight of 1615.56 g/mol, XLogP of 23.50, 15 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-bromo-5-chloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3-chloro-5-methyl-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(furan-2-ylmethyl)thieno[3,2-b]pyridin-7-amine;3,5-dichloro-N-(1,3-thiazol-2-ylmethyl)thieno[3,2-b]pyridin-7-amine is sourced from PubChem (CID 165000061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).