F0541-0302
TL;DR: F0541-0302 (CAS 449786-84-9) is a chemical compound with molecular formula C17H21N3O3S and molecular weight 347.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]butanamide
Also Known As: F0541-0302, 3-methyl-N-[2-(4-methylphenyl)-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl]butanamide, 3-methyl-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]butanamide, N-(5,5-dioxido-2-(p-tolyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-3-methylbutanamide
| Molecular Formula | C17H21N3O3S |
|---|---|
| Molecular Weight | 347.13 g/mol |
| LogP | 2.59372 |
| Topological Polar Surface Area | 81.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.13037 |
| Heavy Atoms | 24 |
| Complexity | 880.54974 |
Chemical Identifiers
| CAS Number | 449786-84-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)CC(C)C |
Product Overview
F0541-0302 (CAS 449786-84-9), with molecular formula C17H21N3O3S and molecular weight 347.13 g/mol. IUPAC: 3-methyl-N-[2-(4-methylphenyl)-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]butanamide.
Chemical Property Profile of F0541-0302
Property Insights of F0541-0302
The XLogP value of 2.59372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0541-0302. The TPSA of 81.06 Ų falls within the moderate polarity range, balancing permeability and solubility for F0541-0302. Following Lipinski's Rule of Five, F0541-0302 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 F0541-0302?
The CAS number of F0541-0302 is 449786-84-9.
What is the molecular formula of F0541-0302?
The molecular formula of F0541-0302 is C17H21N3O3S.
What is the molecular weight of F0541-0302?
The molecular weight of F0541-0302 is 347.13 g/mol.
Where can I buy F0541-0302?
You can request a quote for F0541-0302 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0541-0302?
Yes, KEHONG BIO provides custom synthesis services for F0541-0302 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.