RefChem:265657
TL;DR: RefChem:265657 (CAS 87603-36-9) is a chemical compound with molecular formula C18H22Cl3N3O2 and molecular weight 417.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(tert-butylamino)-3-[(6,7-dichloro-9H-pyrido[3,4-b]indol-4-yl)oxy]propan-2-ol;hydrochloride
Also Known As: 5-(3-tert-Butylamino-2-hydroxypropoxy)-7,8-dichloropyrido(3,4-b)indole chlorhydrate [French], 2-Propanol, 1-((6,7-dichloro-9H-pyrido(3,4-b)indol-4-yl)oxy)-3-((1,1-dimethylethyl)amino)-, hydrochloride, 5-(3-tert-Butylamino-2-hydroxypropoxy)-7,8-dichloropyrido(3,4-b)indole chlorhydrate, 2-Propanol,1-((6,7-dichloro-9H-pyrido -3-( -,hydrochloride, 1-(tert-butylamino)-3-[(6,7-dichloro-9H-pyrido[3,4-b]indol-4-yl)oxy]propan-2-ol hydrochloride
| Molecular Formula | C18H22Cl3N3O2 |
|---|---|
| Molecular Weight | 417.08 g/mol |
| LogP | 4.5725 |
| Topological Polar Surface Area | 70.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.07776 |
| Heavy Atoms | 26 |
| Complexity | 905.9544 |
Chemical Identifiers
| CAS Number | 87603-36-9 |
|---|---|
| SMILES | CC(C)(C)NCC(COC1=C2C3=CC(=C(C=C3NC2=CN=C1)Cl)Cl)O.Cl |
Product Overview
RefChem:265657 (CAS 87603-36-9), with molecular formula C18H22Cl3N3O2 and molecular weight 417.08 g/mol. IUPAC: 1-(tert-butylamino)-3-[(6,7-dichloro-9H-pyrido[3,4-b]indol-4-yl)oxy]propan-2-ol;hydrochloride.
Chemical Property Profile of RefChem:265657
Property Insights of RefChem:265657
The XLogP value of 4.5725 indicates that RefChem:265657 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.17 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:265657. Following Lipinski's Rule of Five, RefChem:265657 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 RefChem:265657?
The CAS number of RefChem:265657 is 87603-36-9.
What is the molecular formula of RefChem:265657?
The molecular formula of RefChem:265657 is C18H22Cl3N3O2.
What is the molecular weight of RefChem:265657?
The molecular weight of RefChem:265657 is 417.08 g/mol.
Where can I buy RefChem:265657?
You can request a quote for RefChem:265657 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:265657?
Yes, KEHONG BIO provides custom synthesis services for RefChem:265657 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.