Isamoltan, (R)-
TL;DR: Isamoltan, (R)- (CAS 116861-01-9) is a chemical compound with molecular formula C16H22N2O2 and molecular weight 274.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-1-(propan-2-ylamino)-3-(2-pyrrol-1-ylphenoxy)propan-2-ol
Also Known As: (+)-Isamoltane, Isamoltan, (R)-, Isamoltane, Isamoltan, (+)-, 2-Anilinoethyl(phenyl)formamide
| Molecular Formula | C16H22N2O2 |
|---|---|
| Molecular Weight | 274.17 g/mol |
| LogP | 2.215 |
| Topological Polar Surface Area | 46.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 274.16812 |
| Heavy Atoms | 20 |
| Complexity | 508.95523 |
Chemical Identifiers
| CAS Number | 116861-01-9 |
|---|---|
| SMILES | CC(C)NC[C@H](COC1=CC=CC=C1N2C=CC=C2)O |
Product Overview
Isamoltan, (R)- (CAS 116861-01-9), with molecular formula C16H22N2O2 and molecular weight 274.17 g/mol. IUPAC: (2R)-1-(propan-2-ylamino)-3-(2-pyrrol-1-ylphenoxy)propan-2-ol.
Chemical Property Profile of Isamoltan, (R)-
Property Insights of Isamoltan, (R)-
The XLogP value of 2.215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isamoltan, (R)-. With a topological polar surface area (TPSA) of 46.42 Ų, Isamoltan, (R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isamoltan, (R)- 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 Isamoltan, (R)-?
The CAS number of Isamoltan, (R)- is 116861-01-9.
What is the molecular formula of Isamoltan, (R)-?
The molecular formula of Isamoltan, (R)- is C16H22N2O2.
What is the molecular weight of Isamoltan, (R)-?
The molecular weight of Isamoltan, (R)- is 274.17 g/mol.
Where can I buy Isamoltan, (R)-?
You can request a quote for Isamoltan, (R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isamoltan, (R)-?
Yes, KEHONG BIO provides custom synthesis services for Isamoltan, (R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.