1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride
TL;DR: 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride (CAS 70100-63-9) is a chemical compound with molecular formula C16H24ClNO3 and molecular weight 313.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]pyrrolidine;hydrochloride
Also Known As: 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride, Pyrrolidine, 1-((3,4-dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)-, hydrochloride, 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]pyrrolidine hydrochloride, 1-[(6,7-Dimethoxy-3,4-dihydro-1H-2-benzopyran-1-yl)methyl]pyrrolidine--hydrogen chloride (1/1), RefChem:377894
| Molecular Formula | C16H24ClNO3 |
|---|---|
| Molecular Weight | 313.14 g/mol |
| LogP | 2.8352 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.14447 |
| Heavy Atoms | 21 |
| Complexity | 474.83505 |
Chemical Identifiers
| CAS Number | 70100-63-9 |
|---|---|
| SMILES | COC1=C(C=C2C(OCCC2=C1)CN3CCCC3)OC.Cl |
Product Overview
1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride (CAS 70100-63-9), with molecular formula C16H24ClNO3 and molecular weight 313.14 g/mol. IUPAC: 1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl]pyrrolidine;hydrochloride.
Chemical Property Profile of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride
Property Insights of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride
The XLogP value of 2.8352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride. With a topological polar surface area (TPSA) of 30.93 Ų, 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine 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 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride?
The CAS number of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride is 70100-63-9.
What is the molecular formula of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride?
The molecular formula of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride is C16H24ClNO3.
What is the molecular weight of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride?
The molecular weight of 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride is 313.14 g/mol.
Where can I buy 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride?
You can request a quote for 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)pyrolidine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.