F1038-0540
TL;DR: F1038-0540 (CAS 681471-86-3) is a chemical compound with molecular formula C27H24N4O3 and molecular weight 452.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 5-methyl-7-(2-phenylmethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: F1038-0540, benzyl 7-[2-(benzyloxy)phenyl]-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, benzyl 7-(2-(benzyloxy)phenyl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, benzyl 5-methyl-7-(2-phenylmethoxyphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate, benzyl 5-methyl-7-(2-phenylmethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
| Molecular Formula | C27H24N4O3 |
|---|---|
| Molecular Weight | 452.18 g/mol |
| LogP | 4.8894 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.18484 |
| Heavy Atoms | 34 |
| Complexity | 1315.9866 |
Chemical Identifiers
| CAS Number | 681471-86-3 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC=N2)N1)C3=CC=CC=C3OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5 |
Product Overview
F1038-0540 (CAS 681471-86-3), with molecular formula C27H24N4O3 and molecular weight 452.18 g/mol. IUPAC: benzyl 5-methyl-7-(2-phenylmethoxyphenyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate.
Chemical Property Profile of F1038-0540
Property Insights of F1038-0540
The XLogP value of 4.8894 indicates that F1038-0540 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.27 Ų falls within the moderate polarity range, balancing permeability and solubility for F1038-0540. Following Lipinski's Rule of Five, F1038-0540 has 1 hydrogen bond donor(s) and 6 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 F1038-0540?
The CAS number of F1038-0540 is 681471-86-3.
What is the molecular formula of F1038-0540?
The molecular formula of F1038-0540 is C27H24N4O3.
What is the molecular weight of F1038-0540?
The molecular weight of F1038-0540 is 452.18 g/mol.
Where can I buy F1038-0540?
You can request a quote for F1038-0540 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1038-0540?
Yes, KEHONG BIO provides custom synthesis services for F1038-0540 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.