A-420983
TL;DR: A-420983 (CAS 330789-03-2) is a chemical compound with molecular formula C33H39N9O2 and molecular weight 593.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[4-amino-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-1-methylindole-2-carboxamide
Also Known As: N-(4-{4-Amino-1-[4-(4-Methylpiperazin-1-Yl)-Trans-Cyclohexyl]-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl}-2-Methoxyphenyl)-1-Methyl-1h-Indole-2-Carboxamide, 1-Methyl-1H-indole-2-carboxylic acid (4-{4-amino-1-[4-(4-methyl-piperazin-1-yl)-cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxy-phenyl)-amide, N-(4-(4-amino-1-((cis)-4-(4-methylpiperazin-1-yl)cyclohexyl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide, N-(4-(4-amino-1-((trans)-4-(4-methylpiperazin-1-yl)cyclohexyl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide, N-(4-{4-amino-1-[trans-4-(4-methylpiperazin-1-yl)cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide
| Molecular Formula | C33H39N9O2 |
|---|---|
| Molecular Weight | 593.32 g/mol |
| LogP | 4.5592 |
| Topological Polar Surface Area | 119.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 593.3227 |
| Heavy Atoms | 44 |
| Complexity | 1828.2018 |
Chemical Identifiers
| CAS Number | 330789-03-2 |
|---|---|
| SMILES | CN1CCN(CC1)C2CCC(CC2)N3C4=NC=NC(=C4C(=N3)C5=CC(=C(C=C5)NC(=O)C6=CC7=CC=CC=C7N6C)OC)N |
Product Overview
A-420983 (CAS 330789-03-2), with molecular formula C33H39N9O2 and molecular weight 593.32 g/mol. IUPAC: N-[4-[4-amino-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-1-methylindole-2-carboxamide.
Chemical Property Profile of A-420983
Property Insights of A-420983
The XLogP value of 4.5592 indicates that A-420983 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.36 Ų falls within the moderate polarity range, balancing permeability and solubility for A-420983. Following Lipinski's Rule of Five, A-420983 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A-420983?
The CAS number of A-420983 is 330789-03-2.
What is the molecular formula of A-420983?
The molecular formula of A-420983 is C33H39N9O2.
What is the molecular weight of A-420983?
The molecular weight of A-420983 is 593.32 g/mol.
Where can I buy A-420983?
You can request a quote for A-420983 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A-420983?
Yes, KEHONG BIO provides custom synthesis services for A-420983 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.