ChemDiv2_007378
TL;DR: ChemDiv2_007378 (CAS 852372-85-1) is a chemical compound with molecular formula C18H14N4O3S and molecular weight 366.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanylmethyl]furan-2-carboxylate
Also Known As: ChemDiv2_007378, IDI1_006093, VU0234520-4, AB00491000-03, F0676-0093
| Molecular Formula | C18H14N4O3S |
|---|---|
| Molecular Weight | 366.08 g/mol |
| LogP | 3.4632 |
| Topological Polar Surface Area | 82.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.07867 |
| Heavy Atoms | 26 |
| Complexity | 1058.6915 |
Chemical Identifiers
| CAS Number | 852372-85-1 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)CSC2=NN3C(=NN=C3C4=CC=CC=C4)C=C2 |
Product Overview
ChemDiv2_007378 (CAS 852372-85-1), with molecular formula C18H14N4O3S and molecular weight 366.08 g/mol. IUPAC: methyl 5-[(3-phenyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanylmethyl]furan-2-carboxylate.
Chemical Property Profile of ChemDiv2_007378
Property Insights of ChemDiv2_007378
The XLogP value of 3.4632 indicates that ChemDiv2_007378 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_007378. Following Lipinski's Rule of Five, ChemDiv2_007378 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 ChemDiv2_007378?
The CAS number of ChemDiv2_007378 is 852372-85-1.
What is the molecular formula of ChemDiv2_007378?
The molecular formula of ChemDiv2_007378 is C18H14N4O3S.
What is the molecular weight of ChemDiv2_007378?
The molecular weight of ChemDiv2_007378 is 366.08 g/mol.
Where can I buy ChemDiv2_007378?
You can request a quote for ChemDiv2_007378 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_007378?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_007378 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.