CAS 450342-59-3 - C18H14N4O4S
TL;DR: CAS 450342-59-3 - C18H14N4O4S (CAS 450342-59-3) is a chemical compound with molecular formula C18H14N4O4S and molecular weight 382.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-yl)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]prop-2-enamide
Also Known As: (2Z)-3-(furan-2-yl)-N-[2-(4-nitrophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]prop-2-enamide
| Molecular Formula | C18H14N4O4S |
|---|---|
| Molecular Weight | 382.07 g/mol |
| LogP | 3.7722 |
| Topological Polar Surface Area | 103.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.07358 |
| Heavy Atoms | 27 |
| Complexity | 1022.57135 |
Chemical Identifiers
| CAS Number | 450342-59-3 |
|---|---|
| SMILES | C1C2=C(N(N=C2CS1)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)/C=C/C4=CC=CO4 |
Product Overview
CAS 450342-59-3 - C18H14N4O4S (CAS 450342-59-3), with molecular formula C18H14N4O4S and molecular weight 382.07 g/mol. IUPAC: (E)-3-(furan-2-yl)-N-[2-(4-nitrophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]prop-2-enamide.
Chemical Property Profile of CAS 450342-59-3 - C18H14N4O4S
Property Insights of CAS 450342-59-3 - C18H14N4O4S
The XLogP value of 3.7722 indicates that CAS 450342-59-3 - C18H14N4O4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.2 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 450342-59-3 - C18H14N4O4S. Following Lipinski's Rule of Five, CAS 450342-59-3 - C18H14N4O4S has 1 hydrogen bond donor(s) and 6 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 CAS 450342-59-3 - C18H14N4O4S?
The CAS number of CAS 450342-59-3 - C18H14N4O4S is 450342-59-3.
What is the molecular formula of CAS 450342-59-3 - C18H14N4O4S?
The molecular formula of CAS 450342-59-3 - C18H14N4O4S is C18H14N4O4S.
What is the molecular weight of CAS 450342-59-3 - C18H14N4O4S?
The molecular weight of CAS 450342-59-3 - C18H14N4O4S is 382.07 g/mol.
Where can I buy CAS 450342-59-3 - C18H14N4O4S?
You can request a quote for CAS 450342-59-3 - C18H14N4O4S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 450342-59-3 - C18H14N4O4S?
Yes, KEHONG BIO provides custom synthesis services for CAS 450342-59-3 - C18H14N4O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.