F0778-0231
TL;DR: F0778-0231 (CAS 396722-18-2) is a chemical compound with molecular formula C20H18N4O5S and molecular weight 426.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dimethoxy-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: F0778-0231, 3,4-dimethoxy-N-(2-(4-nitrophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 3,4-dimethoxy-N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]benzamide, 3,4-dimethoxy-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, N-[3-(p-nitrophenyl)-7-thia-2,3-diazabicyclo[3.3.0]octa-1,4-dien-4-yl]veratramide
| Molecular Formula | C20H18N4O5S |
|---|---|
| Molecular Weight | 426.10 g/mol |
| LogP | 3.7968 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.0998 |
| Heavy Atoms | 30 |
| Complexity | 1126.9707 |
Chemical Identifiers
| CAS Number | 396722-18-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)NC2=C3CSCC3=NN2C4=CC=C(C=C4)[N+](=O)[O-])OC |
Product Overview
F0778-0231 (CAS 396722-18-2), with molecular formula C20H18N4O5S and molecular weight 426.10 g/mol. IUPAC: 3,4-dimethoxy-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of F0778-0231
Property Insights of F0778-0231
The XLogP value of 3.7968 indicates that F0778-0231 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.52 Ų falls within the moderate polarity range, balancing permeability and solubility for F0778-0231. Following Lipinski's Rule of Five, F0778-0231 has 1 hydrogen bond donor(s) and 7 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 F0778-0231?
The CAS number of F0778-0231 is 396722-18-2.
What is the molecular formula of F0778-0231?
The molecular formula of F0778-0231 is C20H18N4O5S.
What is the molecular weight of F0778-0231?
The molecular weight of F0778-0231 is 426.10 g/mol.
Where can I buy F0778-0231?
You can request a quote for F0778-0231 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0778-0231?
Yes, KEHONG BIO provides custom synthesis services for F0778-0231 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.