F0529-0095
TL;DR: F0529-0095 (CAS 476458-92-1) is a chemical compound with molecular formula C19H14N4O5S and molecular weight 410.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide
Also Known As: F0529-0095, N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-2H-1,3-benzodioxole-5-carboxamide, N-(2-(4-nitrophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzo[d][1,3]dioxole-5-carboxamide, N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C19H14N4O5S |
|---|---|
| Molecular Weight | 410.07 g/mol |
| LogP | 3.5083 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 410.06848 |
| Heavy Atoms | 29 |
| Complexity | 1142.2465 |
Chemical Identifiers
| CAS Number | 476458-92-1 |
|---|---|
| SMILES | C1C2=C(N(N=C2CS1)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC5=C(C=C4)OCO5 |
Product Overview
F0529-0095 (CAS 476458-92-1), with molecular formula C19H14N4O5S and molecular weight 410.07 g/mol. IUPAC: N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of F0529-0095
Property Insights of F0529-0095
The XLogP value of 3.5083 indicates that F0529-0095 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 F0529-0095. Following Lipinski's Rule of Five, F0529-0095 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 F0529-0095?
The CAS number of F0529-0095 is 476458-92-1.
What is the molecular formula of F0529-0095?
The molecular formula of F0529-0095 is C19H14N4O5S.
What is the molecular weight of F0529-0095?
The molecular weight of F0529-0095 is 410.07 g/mol.
Where can I buy F0529-0095?
You can request a quote for F0529-0095 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0529-0095?
Yes, KEHONG BIO provides custom synthesis services for F0529-0095 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.