BAS 00123865
TL;DR: BAS 00123865 (CAS 88307-72-6) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)phenol
Also Known As: BAS 00123865, 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)phenol, J2.099.498C, Phenol, 2-(1,2,3,4-tetrahydro-6,7-dimethoxy-1-isoquinolinyl)-, 2-(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-phenol
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 50.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 88307-72-6 |
|---|---|
| SMILES | COC1=C(C=C2C(NCCC2=C1)C3=CC=CC=C3O)OC |
| InChIKey | MHCUVSNFIKUPME-UHFFFAOYSA-N |
Product Overview
BAS 00123865 (CAS 88307-72-6), with molecular formula C17H19NO3 and molecular weight 285.14 g/mol. IUPAC: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)phenol.
Chemical Property Profile of BAS 00123865
Property Insights of BAS 00123865
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00123865. With a topological polar surface area (TPSA) of 50.7 Ų, BAS 00123865 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00123865 has 2 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 BAS 00123865?
The CAS number of BAS 00123865 is 88307-72-6.
What is the molecular formula of BAS 00123865?
The molecular formula of BAS 00123865 is C17H19NO3.
What is the molecular weight of BAS 00123865?
The molecular weight of BAS 00123865 is 285.14 g/mol.
Where can I buy BAS 00123865?
You can request a quote for BAS 00123865 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00123865?
Yes, KEHONG BIO provides custom synthesis services for BAS 00123865 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.