RefChem:245183
TL;DR: RefChem:245183 (CAS 77917-26-1) is a chemical compound with molecular formula C24H25N5O4 and molecular weight 447.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,4-dimethoxyphenyl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione
Also Known As: 1-(2,4-Dimethoxybenzyl)-4-(4-(2-pyrimidinylamino)benzyl)-2,3-dioxopiperazine, 2,3-Piperazinedione, 1-((2,4-dimethoxyphenyl)methyl)-4-((4-(2-pyrmidinylamino)phenyl)methyl)-, 1-((2,4-Dimethoxyphenyl)methyl)-4-((4-(2-pyrmidinylamino)phenyl)methyl)-2,3-piperazinedione, 1-[(2,4-Dimethoxyphenyl)methyl]-4-({4-[(pyrimidin-2-yl)amino]phenyl}methyl)piperazine-2,3-dione, 1-[(2,4-dimethoxyphenyl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione
| Molecular Formula | C24H25N5O4 |
|---|---|
| Molecular Weight | 447.19 g/mol |
| LogP | 2.6084 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 447.19064 |
| Heavy Atoms | 33 |
| Complexity | 1121.4584 |
Chemical Identifiers
| CAS Number | 77917-26-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)CN2CCN(C(=O)C2=O)CC3=CC=C(C=C3)NC4=NC=CC=N4)OC |
Product Overview
RefChem:245183 (CAS 77917-26-1), with molecular formula C24H25N5O4 and molecular weight 447.19 g/mol. IUPAC: 1-[(2,4-dimethoxyphenyl)methyl]-4-[[4-(pyrimidin-2-ylamino)phenyl]methyl]piperazine-2,3-dione.
Chemical Property Profile of RefChem:245183
Property Insights of RefChem:245183
The XLogP value of 2.6084 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:245183. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:245183. Following Lipinski's Rule of Five, RefChem:245183 has 1 hydrogen bond donor(s) and 7 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 RefChem:245183?
The CAS number of RefChem:245183 is 77917-26-1.
What is the molecular formula of RefChem:245183?
The molecular formula of RefChem:245183 is C24H25N5O4.
What is the molecular weight of RefChem:245183?
The molecular weight of RefChem:245183 is 447.19 g/mol.
Where can I buy RefChem:245183?
You can request a quote for RefChem:245183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:245183?
Yes, KEHONG BIO provides custom synthesis services for RefChem:245183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.