C16H13N5O4
TL;DR: C16H13N5O4 (CAS 634886-33-2) is a chemical compound with molecular formula C16H13N5O4 and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(furan-2-yl)ethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide
Also Known As: N'-[(1E)-1-(furan-2-yl)ethylidene]-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide, (E)-N'-(1-(furan-2-yl)ethylidene)-3-(3-nitrophenyl)-1H-pyrazole-5-carbohydrazide, N-((1E)-2-(2-furyl)-1-azaprop-1-enyl)[3-(3-nitrophenyl)pyrazol-5-yl]carboxamid e
| Molecular Formula | C16H13N5O4 |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 2.7319 |
| Topological Polar Surface Area | 126.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.09674 |
| Heavy Atoms | 25 |
| Complexity | 943.108 |
Chemical Identifiers
| CAS Number | 634886-33-2 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1=CC(=NN1)C2=CC(=CC=C2)[N+](=O)[O-])/C3=CC=CO3 |
Product Overview
C16H13N5O4 (CAS 634886-33-2), with molecular formula C16H13N5O4 and molecular weight 339.10 g/mol. IUPAC: N-[(E)-1-(furan-2-yl)ethylideneamino]-3-(3-nitrophenyl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of C16H13N5O4
Property Insights of C16H13N5O4
The XLogP value of 2.7319 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C16H13N5O4. The TPSA of 126.42 Ų falls within the moderate polarity range, balancing permeability and solubility for C16H13N5O4. Following Lipinski's Rule of Five, C16H13N5O4 has 2 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 C16H13N5O4?
The CAS number of C16H13N5O4 is 634886-33-2.
What is the molecular formula of C16H13N5O4?
The molecular formula of C16H13N5O4 is C16H13N5O4.
What is the molecular weight of C16H13N5O4?
The molecular weight of C16H13N5O4 is 339.10 g/mol.
Where can I buy C16H13N5O4?
You can request a quote for C16H13N5O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16H13N5O4?
Yes, KEHONG BIO provides custom synthesis services for C16H13N5O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.