RefChem:265605
TL;DR: RefChem:265605 (CAS 98608-97-0) is a chemical compound with molecular formula C22H31Cl2N3O and molecular weight 423.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(1H-indol-3-yl)ethylamino]-3-(1-phenylpropan-2-ylamino)propan-2-ol;dihydrochloride
Also Known As: 1-((2-(1H-Indol-3-yl)ethyl)amino)-3-((1-methyl-2-phenylethyl)amino)-2-propanol dihydrochloride, N-(beta-(3-Indolyl)ethyl)-N'-(methyl-3-phenyl)ethyl-1,3-diamino-2-propanol dihydrochloride, 2-Propanol, 1-((2-(1H-indol-3-yl)ethyl)amino)-3-((1-methyl-2-phenylethyl)amino)-, dihydrochloride, 1-[2-(1H-indol-3-yl)ethylamino]-3-(1-phenylpropan-2-ylamino)propan-2-ol dihydrochloride, 1-{[2-(1H-Indol-3-yl)ethyl]amino}-3-[(1-phenylpropan-2-yl)amino]propan-2-ol--hydrogen chloride (1/2)
| Molecular Formula | C22H31Cl2N3O |
|---|---|
| Molecular Weight | 423.18 g/mol |
| LogP | 3.7253 |
| Topological Polar Surface Area | 60.08 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 423.18442 |
| Heavy Atoms | 28 |
| Complexity | 794.5909 |
Chemical Identifiers
| CAS Number | 98608-97-0 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)NCC(CNCCC2=CNC3=CC=CC=C32)O.Cl.Cl |
Product Overview
RefChem:265605 (CAS 98608-97-0), with molecular formula C22H31Cl2N3O and molecular weight 423.18 g/mol. IUPAC: 1-[2-(1H-indol-3-yl)ethylamino]-3-(1-phenylpropan-2-ylamino)propan-2-ol;dihydrochloride.
Chemical Property Profile of RefChem:265605
Property Insights of RefChem:265605
The XLogP value of 3.7253 indicates that RefChem:265605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.08 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:265605. Following Lipinski's Rule of Five, RefChem:265605 has 4 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 RefChem:265605?
The CAS number of RefChem:265605 is 98608-97-0.
What is the molecular formula of RefChem:265605?
The molecular formula of RefChem:265605 is C22H31Cl2N3O.
What is the molecular weight of RefChem:265605?
The molecular weight of RefChem:265605 is 423.18 g/mol.
Where can I buy RefChem:265605?
You can request a quote for RefChem:265605 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:265605?
Yes, KEHONG BIO provides custom synthesis services for RefChem:265605 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.