F0541-0013
TL;DR: F0541-0013 (CAS 449783-54-4) is a chemical compound with molecular formula C17H27N3O3S and molecular weight 353.18 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)-2-cyclohexylacetamide
Also Known As: F0541-0013, N-{2-tert-butyl-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl}-2-cyclohexylacetamide, N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-cyclohexylacetamide, N-(2-(tert-butyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-cyclohexylacetamide, 3-tert-butyl-4-[(cyclohexylmethyl)carbonylamino]-7-oxo-7lambda-thia-2,3-diazabicyclo[3.3.0]octa-1,4-dien-7-ium-7-olate
| Molecular Formula | C17H27N3O3S |
|---|---|
| Molecular Weight | 353.18 g/mol |
| LogP | 2.9754 |
| Topological Polar Surface Area | 81.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 353.1773 |
| Heavy Atoms | 24 |
| Complexity | 737.8657 |
Chemical Identifiers
| CAS Number | 449783-54-4 |
|---|---|
| SMILES | CC(C)(C)N1C(=C2CS(=O)(=O)CC2=N1)NC(=O)CC3CCCCC3 |
Product Overview
F0541-0013 (CAS 449783-54-4), with molecular formula C17H27N3O3S and molecular weight 353.18 g/mol. IUPAC: N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-cyclohexylacetamide.
Chemical Property Profile of F0541-0013
Property Insights of F0541-0013
The XLogP value of 2.9754 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0541-0013. The TPSA of 81.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0013. Following Lipinski's Rule of Five, F0541-0013 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 F0541-0013?
The CAS number of F0541-0013 is 449783-54-4.
What is the molecular formula of F0541-0013?
The molecular formula of F0541-0013 is C17H27N3O3S.
What is the molecular weight of F0541-0013?
The molecular weight of F0541-0013 is 353.18 g/mol.
Where can I buy F0541-0013?
You can request a quote for F0541-0013 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0013?
Yes, KEHONG BIO provides custom synthesis services for F0541-0013 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.