![8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine structure](/static/products/799/799792-85-1.png)
8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine
TL;DR: 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine (CAS 799792-85-1) is a chemical compound with molecular formula C21H21ClN4O2 and molecular weight 396.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine
Also Known As: 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine, 8-chloro-N-(3,4-dimethoxyphenethyl)-N-methyl-5H-pyrimido[5,4-b]indol-4-amine
| Molecular Formula | C21H21ClN4O2 |
|---|---|
| Molecular Weight | 396.14 g/mol |
| LogP | 4.4606 |
| Topological Polar Surface Area | 63.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.1353 |
| Heavy Atoms | 28 |
| Complexity | 1142.1213 |
Chemical Identifiers
| CAS Number | 799792-85-1 |
|---|---|
| SMILES | CN(CCC1=CC(=C(C=C1)OC)OC)C2=NC=NC3=C2NC4=C3C=C(C=C4)Cl |
Product Overview
8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine (CAS 799792-85-1), with molecular formula C21H21ClN4O2 and molecular weight 396.14 g/mol. IUPAC: 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine.
Chemical Property Profile of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine
Property Insights of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine
The XLogP value of 4.4606 indicates that 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine. Following Lipinski's Rule of Five, 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine has 1 hydrogen bond donor(s) and 5 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 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine?
The CAS number of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine is 799792-85-1.
What is the molecular formula of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine?
The molecular formula of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine is C21H21ClN4O2.
What is the molecular weight of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine?
The molecular weight of 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine is 396.14 g/mol.
Where can I buy 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine?
You can request a quote for 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 8-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5H-pyrimido[5,4-b]indol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.