A1236/0056819
TL;DR: A1236/0056819 (CAS 339310-55-3) is a chemical compound with molecular formula C28H26N4O2S and molecular weight 482.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,5-dimethylphenyl)-2-[5-(2,5-dimethylphenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]-1,3-thiazole
Also Known As: A1236/0056819, 4-(2,5-dimethylphenyl)-2-(3-(2,5-dimethylphenyl)-5-{3-nitrophenyl}-4,5-dihydro-1H-pyrazol-1-yl)-1,3-thiazole, 4-(2,5-dimethylphenyl)-2-[3-(2,5-dimethylphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole, 4-(2,5-dimethylphenyl)-2-[5-(2,5-dimethylphenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]-1,3-thiazole, 4-(2,5-dimethylphenyl)-2-[3-(2,5-dimethylphenyl)-5-(3-nitrophenyl)(2-pyrazolin yl)]-1,3-thiazole
| Molecular Formula | C28H26N4O2S |
|---|---|
| Molecular Weight | 482.18 g/mol |
| LogP | 7.30768 |
| Topological Polar Surface Area | 71.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.17764 |
| Heavy Atoms | 35 |
| Complexity | 1473.5712 |
Chemical Identifiers
| CAS Number | 339310-55-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C2=NN(C(C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=NC(=CS4)C5=C(C=CC(=C5)C)C |
Product Overview
A1236/0056819 (CAS 339310-55-3), with molecular formula C28H26N4O2S and molecular weight 482.18 g/mol. IUPAC: 4-(2,5-dimethylphenyl)-2-[5-(2,5-dimethylphenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]-1,3-thiazole.
Chemical Property Profile of A1236/0056819
Property Insights of A1236/0056819
The XLogP value of 7.30768 indicates that A1236/0056819 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.63 Ų falls within the moderate polarity range, balancing permeability and solubility for A1236/0056819. Following Lipinski's Rule of Five, A1236/0056819 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1236/0056819?
The CAS number of A1236/0056819 is 339310-55-3.
What is the molecular formula of A1236/0056819?
The molecular formula of A1236/0056819 is C28H26N4O2S.
What is the molecular weight of A1236/0056819?
The molecular weight of A1236/0056819 is 482.18 g/mol.
Where can I buy A1236/0056819?
You can request a quote for A1236/0056819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1236/0056819?
Yes, KEHONG BIO provides custom synthesis services for A1236/0056819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.