RefChem:204145
TL;DR: RefChem:204145 (CAS 106087-41-6) is a chemical compound with molecular formula C22H34N8O2 and molecular weight 442.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,9-trimethyl-1,7-bis(piperidin-1-ylmethyl)-4H-purino[8,7-c][1,2,4]triazine-6,8-dione
Also Known As: (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 1,4-dihydro-1,7-bis(piperidinomethyl)-3,4,9-trimethyl-, 3,4,9-trimethyl-1,7-bis(piperidin-1-ylmethyl)-4H-purino[8,7-c][1,2,4]triazine-6,8-dione, 3,4,9-Trimethyl-1,7-bis[(piperidin-1-yl)methyl]-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione, RefChem:204145
| Molecular Formula | C22H34N8O2 |
|---|---|
| Molecular Weight | 442.28 g/mol |
| LogP | 1.5404 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.2805 |
| Heavy Atoms | 32 |
| Complexity | 1147.3582 |
Chemical Identifiers
| CAS Number | 106087-41-6 |
|---|---|
| SMILES | CC1C(=NN(C2=NC3=C(N12)C(=O)N(C(=O)N3C)CN4CCCCC4)CN5CCCCC5)C |
Product Overview
RefChem:204145 (CAS 106087-41-6), with molecular formula C22H34N8O2 and molecular weight 442.28 g/mol. IUPAC: 3,4,9-trimethyl-1,7-bis(piperidin-1-ylmethyl)-4H-purino[8,7-c][1,2,4]triazine-6,8-dione.
Chemical Property Profile of RefChem:204145
Property Insights of RefChem:204145
The XLogP value of 1.5404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:204145. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:204145. Following Lipinski's Rule of Five, RefChem:204145 has 0 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:204145?
The CAS number of RefChem:204145 is 106087-41-6.
What is the molecular formula of RefChem:204145?
The molecular formula of RefChem:204145 is C22H34N8O2.
What is the molecular weight of RefChem:204145?
The molecular weight of RefChem:204145 is 442.28 g/mol.
Where can I buy RefChem:204145?
You can request a quote for RefChem:204145 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:204145?
Yes, KEHONG BIO provides custom synthesis services for RefChem:204145 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.