Indatraline
TL;DR: Indatraline (CAS 97229-15-7) is a chemical compound with molecular formula C16H15Cl2N and molecular weight 291.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3S)-3-(3,4-dichlorophenyl)-N-methyl-2,3-dihydro-1H-inden-1-amine
Also Known As: Indatraline, Indatralinum, indatralina, Indatraline [INN], (+)-Indatraline
| Molecular Formula | C16H15Cl2N |
|---|---|
| Molecular Weight | 291.06 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.05817 |
| Heavy Atoms | 19 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 97229-15-7 |
|---|---|
| SMILES | CN[C@@H]1C[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | SVFXPTLYMIXFRX-XJKSGUPXSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Indatraline (CAS 97229-15-7), with molecular formula C16H15Cl2N and molecular weight 291.06 g/mol. IUPAC: (1R,3S)-3-(3,4-dichlorophenyl)-N-methyl-2,3-dihydro-1H-inden-1-amine.
Chemical Property Profile of Indatraline
Property Insights of Indatraline
The XLogP value of 4.4 indicates that Indatraline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Indatraline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indatraline has 1 hydrogen bond donor(s) and 1 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 Indatraline?
The CAS number of Indatraline is 97229-15-7.
What is the molecular formula of Indatraline?
The molecular formula of Indatraline is C16H15Cl2N.
What is the molecular weight of Indatraline?
The molecular weight of Indatraline is 291.06 g/mol.
Where can I buy Indatraline?
You can request a quote for Indatraline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Indatraline?
Yes, KEHONG BIO provides custom synthesis services for Indatraline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.