F0541-0018
TL;DR: F0541-0018 (CAS 449783-64-6) is a chemical compound with molecular formula C14H17N3O3S2 and molecular weight 339.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide
Also Known As: F0541-0018, N-{2-tert-butyl-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl}thiophene-2-carboxamide, N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide, N-(2-(tert-butyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide, 3-tert-butyl-7-oxo-4-(2-thenylamino)-7lambda-thia-2,3-diazabicyclo[3.3.0]octa-1,4-dien-7-ium-7-olate
| Molecular Formula | C14H17N3O3S2 |
|---|---|
| Molecular Weight | 339.07 g/mol |
| LogP | 2.3803 |
| Topological Polar Surface Area | 81.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.07114 |
| Heavy Atoms | 22 |
| Complexity | 827.5552 |
Chemical Identifiers
| CAS Number | 449783-64-6 |
|---|---|
| SMILES | CC(C)(C)N1C(=C2CS(=O)(=O)CC2=N1)NC(=O)C3=CC=CS3 |
Product Overview
F0541-0018 (CAS 449783-64-6), with molecular formula C14H17N3O3S2 and molecular weight 339.07 g/mol. IUPAC: N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)thiophene-2-carboxamide.
Chemical Property Profile of F0541-0018
Property Insights of F0541-0018
The XLogP value of 2.3803 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0541-0018. The TPSA of 81.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0018. Following Lipinski's Rule of Five, F0541-0018 has 1 hydrogen bond donor(s) and 5 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 F0541-0018?
The CAS number of F0541-0018 is 449783-64-6.
What is the molecular formula of F0541-0018?
The molecular formula of F0541-0018 is C14H17N3O3S2.
What is the molecular weight of F0541-0018?
The molecular weight of F0541-0018 is 339.07 g/mol.
Where can I buy F0541-0018?
You can request a quote for F0541-0018 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0018?
Yes, KEHONG BIO provides custom synthesis services for F0541-0018 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.