ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate
TL;DR: ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate (CAS 302918-70-3) is a chemical compound with molecular formula C17H13ClN4O3S and molecular weight 388.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(E)-[[5-(5-chlorothiophen-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]benzoate
Also Known As: BAS 01859530, ME 4-(2-((3-(5-CL-2-THIENYL)-1H-PYRAZOL-5-YL)CARBONYL)CARBOHYDRAZONOYL)BENZOATE, Methyl 4-((2-(5-(5-chlorothiophen-2-yl)-1H-pyrazole-3-carbonyl)hydrazono)methyl)benzoate, 4-{[5-(5-Chloro-thiophen-2-yl)-2H-pyrazole-3-carbonyl]-hydrazonomethyl}-benzoic, 651-496-6
| Molecular Formula | C17H13ClN4O3S |
|---|---|
| Molecular Weight | 388.04 g/mol |
| LogP | 3.3421 |
| Topological Polar Surface Area | 96.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.0397 |
| Heavy Atoms | 26 |
| Complexity | 962.5606 |
Chemical Identifiers
| CAS Number | 302918-70-3 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)C2=NNC(=C2)C3=CC=C(S3)Cl |
Product Overview
ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate (CAS 302918-70-3), with molecular formula C17H13ClN4O3S and molecular weight 388.04 g/mol. IUPAC: methyl 4-[(E)-[[5-(5-chlorothiophen-2-yl)-1H-pyrazole-3-carbonyl]hydrazinylidene]methyl]benzoate.
Chemical Property Profile of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate
Property Insights of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate
The XLogP value of 3.3421 indicates that ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.44 Ų falls within the moderate polarity range, balancing permeability and solubility for ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate. Following Lipinski's Rule of Five, ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate 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 ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate?
The CAS number of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is 302918-70-3.
What is the molecular formula of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate?
The molecular formula of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is C17H13ClN4O3S.
What is the molecular weight of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate?
The molecular weight of ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is 388.04 g/mol.
Where can I buy ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate?
You can request a quote for ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ME 4-(2-((3-(5-CL-2-Thienyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.