1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol
TL;DR: 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol (CAS 447433-43-4) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-yl-3,4-dihydroisoquinoline-6,7-diol
Also Known As: ChemDiv1_028215, MixCom6_000407, 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol, 6,7-Isoquinolinediol,3,4-dihydro-1- -, 6,7-Isoquinolinediol, 3,4-dihydro-1-(1-methylethyl)-
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 447433-43-4 |
|---|---|
| SMILES | CC(C)C1=NCCC2=CC(=C(C=C21)O)O |
| InChIKey | BGWWZJVIBUPAAB-UHFFFAOYSA-N |
Product Overview
1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol (CAS 447433-43-4), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 1-propan-2-yl-3,4-dihydroisoquinoline-6,7-diol.
Chemical Property Profile of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol
Property Insights of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol. With a topological polar surface area (TPSA) of 52.8 Ų, 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol has 2 hydrogen bond donor(s) and 3 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-Isopropyl-3,4-dihydroisoquinoline-6,7-diol?
The CAS number of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol is 447433-43-4.
What is the molecular formula of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol?
The molecular formula of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol is C12H15NO2.
What is the molecular weight of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol?
The molecular weight of 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol is 205.11 g/mol.
Where can I buy 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol?
You can request a quote for 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol?
Yes, KEHONG BIO provides custom synthesis services for 1-Isopropyl-3,4-dihydroisoquinoline-6,7-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.