![1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] structure](/static/products/5423/54239-57-5.webp)
1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]
TL;DR: 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] (CAS 54239-57-5) is a chemical compound with molecular formula C12H17Cl2N3O and molecular weight 289.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-chloro-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile;hydrochloride
Also Known As: 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German], Benzonitrile, 2-amino-3-chloro-5-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, monohydrochloride, 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid, 2-amino-3-chloro-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile hydrochloride, 2-Amino-3-chloro-5-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzonitrile--hydrogen chloride (1/1)
| Molecular Formula | C12H17Cl2N3O |
|---|---|
| Molecular Weight | 289.07 g/mol |
| LogP | 2.24708 |
| Topological Polar Surface Area | 82.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.07486 |
| Heavy Atoms | 18 |
| Complexity | 443.68405 |
Chemical Identifiers
| CAS Number | 54239-57-5 |
|---|---|
| SMILES | CC(C)NCC(C1=CC(=C(C(=C1)Cl)N)C#N)O.Cl |
Product Overview
1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] (CAS 54239-57-5), with molecular formula C12H17Cl2N3O and molecular weight 289.07 g/mol. IUPAC: 2-amino-3-chloro-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile;hydrochloride.
Chemical Property Profile of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]
Property Insights of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]
The XLogP value of 2.24708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]. The TPSA of 82.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]. Following Lipinski's Rule of Five, 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] has 3 hydrogen bond donor(s) and 4 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 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]?
The CAS number of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] is 54239-57-5.
What is the molecular formula of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]?
The molecular formula of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] is C12H17Cl2N3O.
What is the molecular weight of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]?
The molecular weight of 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] is 289.07 g/mol.
Where can I buy 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]?
You can request a quote for 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German]?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Amino-3-chlor-5-cyan-phenyl)-2-isopropylamino-aethanol-hydrochlorid [German] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.