RefChem:265739
TL;DR: RefChem:265739 (CAS 76210-97-4) is a chemical compound with molecular formula C18H24ClN3O4 and molecular weight 381.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]propan-2-ol;hydrochloride
Also Known As: 1-(3-Methylphenoxy)-3-((2-(m-nitroanilino)ethyl)amino)-2-propanol hydrochloride, 2-Propanol, 1-(3-methylphenoxy)-3-((2-(m-nitroanilino)ethyl)amino)-, monohydrochloride, 2-Propanol, 1-(3-methylphenoxy)-3-((2-((3-nitrophenyl)amino)ethyl)amino)-, HCl (10CI), 1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]propan-2-ol hydrochloride, 2-Propanol, 1-(3-methylphenoxy)-3-((2-((3-nitrophenyl)amino)ethyl)amino)-, HCl
| Molecular Formula | C18H24ClN3O4 |
|---|---|
| Molecular Weight | 381.15 g/mol |
| LogP | 2.76642 |
| Topological Polar Surface Area | 96.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 381.14554 |
| Heavy Atoms | 26 |
| Complexity | 699.64136 |
Chemical Identifiers
| CAS Number | 76210-97-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC(CNCCNC2=CC(=CC=C2)[N+](=O)[O-])O.Cl |
Product Overview
RefChem:265739 (CAS 76210-97-4), with molecular formula C18H24ClN3O4 and molecular weight 381.15 g/mol. IUPAC: 1-(3-methylphenoxy)-3-[2-(3-nitroanilino)ethylamino]propan-2-ol;hydrochloride.
Chemical Property Profile of RefChem:265739
Property Insights of RefChem:265739
The XLogP value of 2.76642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:265739. The TPSA of 96.66 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:265739. Following Lipinski's Rule of Five, RefChem:265739 has 3 hydrogen bond donor(s) and 6 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:265739?
The CAS number of RefChem:265739 is 76210-97-4.
What is the molecular formula of RefChem:265739?
The molecular formula of RefChem:265739 is C18H24ClN3O4.
What is the molecular weight of RefChem:265739?
The molecular weight of RefChem:265739 is 381.15 g/mol.
Where can I buy RefChem:265739?
You can request a quote for RefChem:265739 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:265739?
Yes, KEHONG BIO provides custom synthesis services for RefChem:265739 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.