IFLab1_002293
TL;DR: IFLab1_002293 (CAS 449783-52-2) is a chemical compound with molecular formula C20H33N3O3S and molecular weight 395.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)cyclohexane-1-carboxamide
Also Known As: IFLab1_002293, F0541-0012, 4-butyl-N-(2-(tert-butyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)cyclohexanecarboxamide, 4-butyl-N-{2-tert-butyl-5,5-dioxo-2H,4H,6H-5lambda6-thieno[3,4-c]pyrazol-3-yl}cyclohexane-1-carboxamide, 4-butyl-N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)cyclohexane-1-carboxamide
| Molecular Formula | C20H33N3O3S |
|---|---|
| Molecular Weight | 395.22 g/mol |
| LogP | 4.0016 |
| Topological Polar Surface Area | 81.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.22427 |
| Heavy Atoms | 27 |
| Complexity | 797.17365 |
Chemical Identifiers
| CAS Number | 449783-52-2 |
|---|---|
| SMILES | CCCCC1CCC(CC1)C(=O)NC2=C3CS(=O)(=O)CC3=NN2C(C)(C)C |
Product Overview
IFLab1_002293 (CAS 449783-52-2), with molecular formula C20H33N3O3S and molecular weight 395.22 g/mol. IUPAC: 4-butyl-N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)cyclohexane-1-carboxamide.
Chemical Property Profile of IFLab1_002293
Property Insights of IFLab1_002293
The XLogP value of 4.0016 indicates that IFLab1_002293 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.06 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_002293. Following Lipinski's Rule of Five, IFLab1_002293 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 IFLab1_002293?
The CAS number of IFLab1_002293 is 449783-52-2.
What is the molecular formula of IFLab1_002293?
The molecular formula of IFLab1_002293 is C20H33N3O3S.
What is the molecular weight of IFLab1_002293?
The molecular weight of IFLab1_002293 is 395.22 g/mol.
Where can I buy IFLab1_002293?
You can request a quote for IFLab1_002293 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_002293?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_002293 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.