BRD-K40621097-001-01-2
TL;DR: BRD-K40621097-001-01-2 (CAS 393786-42-0) is a chemical compound with molecular formula C20H18ClN5O and molecular weight 379.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-methoxyphenyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
Also Known As: BRD-K40621097-001-01-2, N-(5-chloro-2-methoxyphenyl)-1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, F0517-0390, N-(5-chloro-2-methoxyphenyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
| Molecular Formula | C20H18ClN5O |
|---|---|
| Molecular Weight | 379.12 g/mol |
| LogP | 4.83794 |
| Topological Polar Surface Area | 64.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.12 |
| Heavy Atoms | 27 |
| Complexity | 1138.6326 |
Chemical Identifiers
| CAS Number | 393786-42-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C3=NC=NC(=C3C=N2)NC4=C(C=CC(=C4)Cl)OC)C |
Product Overview
BRD-K40621097-001-01-2 (CAS 393786-42-0), with molecular formula C20H18ClN5O and molecular weight 379.12 g/mol. IUPAC: N-(5-chloro-2-methoxyphenyl)-1-(2,4-dimethylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine.
Chemical Property Profile of BRD-K40621097-001-01-2
Property Insights of BRD-K40621097-001-01-2
The XLogP value of 4.83794 indicates that BRD-K40621097-001-01-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K40621097-001-01-2. Following Lipinski's Rule of Five, BRD-K40621097-001-01-2 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 BRD-K40621097-001-01-2?
The CAS number of BRD-K40621097-001-01-2 is 393786-42-0.
What is the molecular formula of BRD-K40621097-001-01-2?
The molecular formula of BRD-K40621097-001-01-2 is C20H18ClN5O.
What is the molecular weight of BRD-K40621097-001-01-2?
The molecular weight of BRD-K40621097-001-01-2 is 379.12 g/mol.
Where can I buy BRD-K40621097-001-01-2?
You can request a quote for BRD-K40621097-001-01-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K40621097-001-01-2?
Yes, KEHONG BIO provides custom synthesis services for BRD-K40621097-001-01-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.