3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-
TL;DR: 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- (CAS 243858-56-2) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl carbamate
Also Known As: RWJ-432205 free base, 1,2,3,4-tetrahydroisoquinolin-3-ylmethyl Carbamate, 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-
| Molecular Formula | C11H14N2O2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 0.7962 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.10553 |
| Heavy Atoms | 15 |
| Complexity | 365.36047 |
Chemical Identifiers
| CAS Number | 243858-56-2 |
|---|---|
| SMILES | C1[C@H](NCC2=CC=CC=C21)COC(=O)N |
Product Overview
3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- (CAS 243858-56-2), with molecular formula C11H14N2O2 and molecular weight 206.11 g/mol. IUPAC: [(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]methyl carbamate.
Chemical Property Profile of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-
Property Insights of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-
The XLogP value of 0.7962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-. Following Lipinski's Rule of Five, 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- 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 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-?
The CAS number of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- is 243858-56-2.
What is the molecular formula of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-?
The molecular formula of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- is C11H14N2O2.
What is the molecular weight of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-?
The molecular weight of 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- is 206.11 g/mol.
Where can I buy 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-?
You can request a quote for 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, carbamate (ester), (3S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.