BRD-K55410718-001-01-1
TL;DR: BRD-K55410718-001-01-1 (CAS 393822-92-9) is a chemical compound with molecular formula C21H21N5O and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine
Also Known As: BRD-K55410718-001-01-1, [1-(2,4-dimethylphenyl)pyrazolo[4,5-e]pyrimidin-4-yl][(2-methoxyphenyl)methyl] amine, 1-(2,4-dimethylphenyl)-N-(2-methoxybenzyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, 1-(2,4-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine, 1-(2,4-DIMETHYLPHENYL)-N-[(2-METHOXYPHENYL)METHYL]-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINE
| Molecular Formula | C21H21N5O |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 4.05304 |
| Topological Polar Surface Area | 64.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.17462 |
| Heavy Atoms | 27 |
| Complexity | 1102.8813 |
Chemical Identifiers
| CAS Number | 393822-92-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C3=NC=NC(=C3C=N2)NCC4=CC=CC=C4OC)C |
Product Overview
BRD-K55410718-001-01-1 (CAS 393822-92-9), with molecular formula C21H21N5O and molecular weight 359.17 g/mol. IUPAC: 1-(2,4-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine.
Chemical Property Profile of BRD-K55410718-001-01-1
Property Insights of BRD-K55410718-001-01-1
The XLogP value of 4.05304 indicates that BRD-K55410718-001-01-1 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-K55410718-001-01-1. Following Lipinski's Rule of Five, BRD-K55410718-001-01-1 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-K55410718-001-01-1?
The CAS number of BRD-K55410718-001-01-1 is 393822-92-9.
What is the molecular formula of BRD-K55410718-001-01-1?
The molecular formula of BRD-K55410718-001-01-1 is C21H21N5O.
What is the molecular weight of BRD-K55410718-001-01-1?
The molecular weight of BRD-K55410718-001-01-1 is 359.17 g/mol.
Where can I buy BRD-K55410718-001-01-1?
You can request a quote for BRD-K55410718-001-01-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K55410718-001-01-1?
Yes, KEHONG BIO provides custom synthesis services for BRD-K55410718-001-01-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.