D0C3BA
TL;DR: D0C3BA (CAS 151406-07-4) is a chemical compound with molecular formula C22H22N8 and molecular weight 398.19675 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,7-diethyl-5-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-b][1,2,4]triazole
Also Known As: 2,7-Diethyl-5-[[2 -(1H-tetrazol-5-yl)[1,1 -biphenyl]-4-yl]methyl]-5H-pyrazolo[1,5-b][1,2,4]triazole, 2,7-Diethyl-5-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-5H-pyrazolo[1,5-b][1,2,4]triazole, 2,7-Diethyl-5-[2'-(1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-5H-pyrazolo[1,5-b][1,2,4]triazole potassium salt monohydrate, 5-[4'-({2,7-diethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-5-yl}methyl)-[1,1'-biphenyl]-2-yl]-1H-1,2,3,4-tetrazole
Technical Specifications
| Molecular Formula | C22H22N8 |
| Molecular Weight | 398.19675 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 89.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.19675 Da |
| Heavy Atoms | 30 |
| Complexity | 553.0 |
| SMILES | CCC1=CN(N2C1=NC(=N2)CC)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5 |
| InChIKey | LASWNZRBIPFGHP-UHFFFAOYSA-N |
Chemical Property Profile of D0C3BA
Property Insights of D0C3BA
The XLogP value of 4.8 indicates that D0C3BA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for D0C3BA. Following Lipinski's Rule of Five, D0C3BA 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
What is the CAS number of D0C3BA?
The CAS number of D0C3BA is 151406-07-4.
What is the molecular formula of D0C3BA?
The molecular formula of D0C3BA is C22H22N8.
What is the molecular weight of D0C3BA?
The molecular weight of D0C3BA is 398.19675 g/mol.
Where can I buy D0C3BA?
You can request a quote for D0C3BA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for D0C3BA?
Yes, CoreyChem provides custom synthesis services for D0C3BA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.