F2780-0036
TL;DR: F2780-0036 (CAS 899741-40-3) is a chemical compound with molecular formula C20H17ClN4O2S and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-N'-(2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)oxamide
Also Known As: F2780-0036, N'-[(2-chlorophenyl)methyl]-N-{2-phenyl-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl}ethanediamide, N-[(2-chlorophenyl)methyl]-N'-(2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)oxamide, N1-(2-chlorobenzyl)-N2-(2-phenyl-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)oxalamide
| Molecular Formula | C20H17ClN4O2S |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 3.5274 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.07608 |
| Heavy Atoms | 28 |
| Complexity | 1035.94 |
Chemical Identifiers
| CAS Number | 899741-40-3 |
|---|---|
| SMILES | C1C2=C(N(N=C2CS1)C3=CC=CC=C3)NC(=O)C(=O)NCC4=CC=CC=C4Cl |
Product Overview
F2780-0036 (CAS 899741-40-3), with molecular formula C20H17ClN4O2S and molecular weight 412.08 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-N'-(2-phenyl-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)oxamide.
Chemical Property Profile of F2780-0036
Property Insights of F2780-0036
The XLogP value of 3.5274 indicates that F2780-0036 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F2780-0036. Following Lipinski's Rule of Five, F2780-0036 has 2 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 F2780-0036?
The CAS number of F2780-0036 is 899741-40-3.
What is the molecular formula of F2780-0036?
The molecular formula of F2780-0036 is C20H17ClN4O2S.
What is the molecular weight of F2780-0036?
The molecular weight of F2780-0036 is 412.08 g/mol.
Where can I buy F2780-0036?
You can request a quote for F2780-0036 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2780-0036?
Yes, KEHONG BIO provides custom synthesis services for F2780-0036 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.