2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride

C14H14Cl3NS — CID 54584661

IUPAC2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
SMILESCN1CC(C2=C(C1)SC(=C2)Cl)C3=CC=C(C=C3)Cl.Cl
InChIInChI=1S/C14H13Cl2NS.ClH/c1-17-7-12(9-2-4-10(15)5-3-9)11-6-14(16)18-13(11)8-17;/h2-6,12H,7-8H2,1H3;1H
InChIKeyMKJLLFSPJNSRBS-UHFFFAOYSA-N
MW334.70 g/mol
LogP—
Rot. Bonds1

About 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride

2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride (PubChem CID 54584661) has the molecular formula C14H14Cl3NS and a molecular weight of 334.70 g/mol. Its IUPAC name is 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride.

Molecular Properties

Compound Name2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
PubChem CID54584661
Molecular FormulaC14H14Cl3NS
Molecular Weight334.70 g/mol
Exact Mass332.99
IUPAC Name2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
SMILESCN1CC(C2=C(C1)SC(=C2)Cl)C3=CC=C(C=C3)Cl.Cl
InChIInChI=1S/C14H13Cl2NS.ClH/c1-17-7-12(9-2-4-10(15)5-3-9)11-6-14(16)18-13(11)8-17;/h2-6,12H,7-8H2,1H3;1H
InChIKeyMKJLLFSPJNSRBS-UHFFFAOYSA-N
XLogP—
TPSA31.50 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity294

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride with MolForge

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Related Compounds

Ticlopidine
CID 5472
Ticlopidine Hydrochloride
CID 65335
4-(4-Chlorophenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
CID 2739269
4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-amine
CID 13210725
Thieno(3,2-c)pyridine, 4,5,6,7-tetrahydro-5-((4-chlorophenyl)methyl)-, monohydrochloride
CID 3041280
Ticlopidine N-Oxide
CID 71752573
1-[(5-Chloro-1-benzothien-3-yl)methyl]piperidine
CID 15945612
4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54581760
4-(4-bromophenyl)-2-chloro-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54584660
2,6-diethyl-4-(4-methylphenyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54584689
2,6-dimethyl-4-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54586592
2-chloro-6-methyl-4-(4-methylphenyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54587607

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The IUPAC name of 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride (CID 54584661) is 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride.
What is the SMILES notation for 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The canonical SMILES for 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride is CN1CC(C2=C(C1)SC(=C2)Cl)C3=CC=C(C=C3)Cl.Cl.
What is the InChIKey of 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The InChIKey is MKJLLFSPJNSRBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NS.ClH/c1-17-7-12(9-2-4-10(15)5-3-9)11-6-14(16)18-13(11)8-17;/h2-6,12H,7-8H2,1H3;1H.
What are the key properties of 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride has a molecular weight of 334.70 g/mol, XLogP of not available, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(4-chlorophenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride is sourced from PubChem (CID 54584661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).