CAS 56217-89-1 - C12H18ClN5O4
TL;DR: CAS 56217-89-1 - C12H18ClN5O4 (CAS 56217-89-1) is a chemical compound with molecular formula C12H18ClN5O4 and molecular weight 331.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylpiperazin-1-yl)-N-[(5-nitrofuran-2-yl)methylideneamino]acetamide;hydrochloride
Also Known As: 1-Piperazineacetic acid, 4-methyl-, 2-[(5-nitro-2-furanyl)methylene]hydrazide, hydrochloride (1:1)
| Molecular Formula | C12H18ClN5O4 |
|---|---|
| Molecular Weight | 331.10 g/mol |
| LogP | 0.3071 |
| Topological Polar Surface Area | 104.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.10474 |
| Heavy Atoms | 22 |
| Complexity | 539.37384 |
Chemical Identifiers
| CAS Number | 56217-89-1 |
|---|---|
| SMILES | CN1CCN(CC1)CC(=O)NN=CC2=CC=C(O2)[N+](=O)[O-].Cl |
Product Overview
CAS 56217-89-1 - C12H18ClN5O4 (CAS 56217-89-1), with molecular formula C12H18ClN5O4 and molecular weight 331.10 g/mol. IUPAC: 2-(4-methylpiperazin-1-yl)-N-[(5-nitrofuran-2-yl)methylideneamino]acetamide;hydrochloride.
Chemical Property Profile of CAS 56217-89-1 - C12H18ClN5O4
Property Insights of CAS 56217-89-1 - C12H18ClN5O4
The XLogP value of 0.3071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 56217-89-1 - C12H18ClN5O4. The TPSA of 104.22 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 56217-89-1 - C12H18ClN5O4. Following Lipinski's Rule of Five, CAS 56217-89-1 - C12H18ClN5O4 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 CAS 56217-89-1 - C12H18ClN5O4?
The CAS number of CAS 56217-89-1 - C12H18ClN5O4 is 56217-89-1.
What is the molecular formula of CAS 56217-89-1 - C12H18ClN5O4?
The molecular formula of CAS 56217-89-1 - C12H18ClN5O4 is C12H18ClN5O4.
What is the molecular weight of CAS 56217-89-1 - C12H18ClN5O4?
The molecular weight of CAS 56217-89-1 - C12H18ClN5O4 is 331.10 g/mol.
Where can I buy CAS 56217-89-1 - C12H18ClN5O4?
You can request a quote for CAS 56217-89-1 - C12H18ClN5O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 56217-89-1 - C12H18ClN5O4?
Yes, KEHONG BIO provides custom synthesis services for CAS 56217-89-1 - C12H18ClN5O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.