BAS 12971436
TL;DR: BAS 12971436 (CAS 866896-19-7) is a chemical compound with molecular formula C19H20N4O2 and molecular weight 336.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,5-dimethylphenyl)-1-(2-methoxyphenyl)-5-methyltriazole-4-carboxamide
Also Known As: BAS 12971436, N-(2,5-dimethylphenyl)-1-(2-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide, F1607-0625, N-(2,5-dimethylphenyl)-1-(2-methoxyphenyl)-5-methyltriazole-4-carboxamide, N-(2,5-dimethylphenyl)[1-(2-methoxyphenyl)-5-methyl(1,2,3-triazol-4-yl)]carbox amide
| Molecular Formula | C19H20N4O2 |
|---|---|
| Molecular Weight | 336.16 g/mol |
| LogP | 3.45346 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.15863 |
| Heavy Atoms | 25 |
| Complexity | 930.9236 |
Chemical Identifiers
| CAS Number | 866896-19-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)C2=C(N(N=N2)C3=CC=CC=C3OC)C |
Product Overview
BAS 12971436 (CAS 866896-19-7), with molecular formula C19H20N4O2 and molecular weight 336.16 g/mol. IUPAC: N-(2,5-dimethylphenyl)-1-(2-methoxyphenyl)-5-methyltriazole-4-carboxamide.
Chemical Property Profile of BAS 12971436
Property Insights of BAS 12971436
The XLogP value of 3.45346 indicates that BAS 12971436 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12971436. Following Lipinski's Rule of Five, BAS 12971436 has 1 hydrogen bond donor(s) and 4 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 BAS 12971436?
The CAS number of BAS 12971436 is 866896-19-7.
What is the molecular formula of BAS 12971436?
The molecular formula of BAS 12971436 is C19H20N4O2.
What is the molecular weight of BAS 12971436?
The molecular weight of BAS 12971436 is 336.16 g/mol.
Where can I buy BAS 12971436?
You can request a quote for BAS 12971436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12971436?
Yes, KEHONG BIO provides custom synthesis services for BAS 12971436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.