1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide
TL;DR: 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide (CAS 14052-75-6) is a chemical compound with molecular formula C11H15N5O3S and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]piperazine-1-carbothioamide
Also Known As: 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide, 4-Methyl-1-piperazinecarbothioic acid (5-nitrofurfurylidene)hydrazide, 4-Methyl-N -(5-nitrofurfurylidene)-1-piperazinecarbothiohydrazide, 4-Methyl-N -(5-nitrofurfurylidene)piperazine-1-carbothiohydrazide, 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]piperazine-1-carbothioamide
| Molecular Formula | C11H15N5O3S |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 0.6436 |
| Topological Polar Surface Area | 87.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.08957 |
| Heavy Atoms | 20 |
| Complexity | 521.8832 |
Chemical Identifiers
| CAS Number | 14052-75-6 |
|---|---|
| SMILES | CN1CCN(CC1)C(=S)N/N=C/C2=CC=C(O2)[N+](=O)[O-] |
Product Overview
1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide (CAS 14052-75-6), with molecular formula C11H15N5O3S and molecular weight 297.09 g/mol. IUPAC: 4-methyl-N-[(E)-(5-nitrofuran-2-yl)methylideneamino]piperazine-1-carbothioamide.
Chemical Property Profile of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide
Property Insights of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide
The XLogP value of 0.6436 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide. The TPSA of 87.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide. Following Lipinski's Rule of Five, 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide 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 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide?
The CAS number of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide is 14052-75-6.
What is the molecular formula of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide?
The molecular formula of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide is C11H15N5O3S.
What is the molecular weight of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide?
The molecular weight of 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide is 297.09 g/mol.
Where can I buy 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide?
You can request a quote for 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarbothioic acid, 4-methyl-, (5-nitrofurfurylidene)hydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.