5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride
TL;DR: 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride (CAS 53885-57-7) is a chemical compound with molecular formula C14H15ClN2O2S and molecular weight 310.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-nitrophenyl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine;hydrochloride
Also Known As: 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride, Thieno(3,2-c)pyridine, 4,5,6,7-tetrahydro-5-((2-nitrophenyl)methyl)-, monohydrochloride, 5-[(2-nitrophenyl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine hydrochloride, 5-[(2-Nitrophenyl)methyl]-4,5,6,7-tetrahydrothieno[3,2-c]pyridine--hydrogen chloride (1/1), RefChem:385008
| Molecular Formula | C14H15ClN2O2S |
|---|---|
| Molecular Weight | 310.05 g/mol |
| LogP | 3.6364 |
| Topological Polar Surface Area | 46.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.0543 |
| Heavy Atoms | 20 |
| Complexity | 614.7263 |
Chemical Identifiers
| CAS Number | 53885-57-7 |
|---|---|
| SMILES | C1CN(CC2=C1SC=C2)CC3=CC=CC=C3[N+](=O)[O-].Cl |
Product Overview
5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride (CAS 53885-57-7), with molecular formula C14H15ClN2O2S and molecular weight 310.05 g/mol. IUPAC: 5-[(2-nitrophenyl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine;hydrochloride.
Chemical Property Profile of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride
Property Insights of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride
The XLogP value of 3.6364 indicates that 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.38 Ų, 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride?
The CAS number of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride is 53885-57-7.
What is the molecular formula of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride?
The molecular formula of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride is C14H15ClN2O2S.
What is the molecular weight of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride?
The molecular weight of 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride is 310.05 g/mol.
Where can I buy 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride?
You can request a quote for 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Nitrobenzyl)-4,5,6,7-tetrahydrothieno(3,2-c)pyridine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.