BRD-K63994050-001-01-0
TL;DR: BRD-K63994050-001-01-0 (CAS 393820-56-9) is a chemical compound with molecular formula C20H18ClN5 and molecular weight 363.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)ethyl]-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
Also Known As: BRD-K63994050-001-01-0, N-(4-Chlorophenethyl)-1-(m-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, N-[2-(4-chlorophenyl)ethyl]-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, N-[2-(4-chlorophenyl)ethyl]-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
| Molecular Formula | C20H18ClN5 |
|---|---|
| Molecular Weight | 363.13 g/mol |
| LogP | 4.43192 |
| Topological Polar Surface Area | 55.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.12506 |
| Heavy Atoms | 26 |
| Complexity | 1039.7025 |
Chemical Identifiers
| CAS Number | 393820-56-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C3=NC=NC(=C3C=N2)NCCC4=CC=C(C=C4)Cl |
Product Overview
BRD-K63994050-001-01-0 (CAS 393820-56-9), with molecular formula C20H18ClN5 and molecular weight 363.13 g/mol. IUPAC: N-[2-(4-chlorophenyl)ethyl]-1-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine.
Chemical Property Profile of BRD-K63994050-001-01-0
Property Insights of BRD-K63994050-001-01-0
The XLogP value of 4.43192 indicates that BRD-K63994050-001-01-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.63 Ų, BRD-K63994050-001-01-0 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BRD-K63994050-001-01-0 has 1 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 BRD-K63994050-001-01-0?
The CAS number of BRD-K63994050-001-01-0 is 393820-56-9.
What is the molecular formula of BRD-K63994050-001-01-0?
The molecular formula of BRD-K63994050-001-01-0 is C20H18ClN5.
What is the molecular weight of BRD-K63994050-001-01-0?
The molecular weight of BRD-K63994050-001-01-0 is 363.13 g/mol.
Where can I buy BRD-K63994050-001-01-0?
You can request a quote for BRD-K63994050-001-01-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K63994050-001-01-0?
Yes, KEHONG BIO provides custom synthesis services for BRD-K63994050-001-01-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.