3-[[Amino(nitramido)methylidene]amino]propyl acetate
TL;DR: 3-[[Amino(nitramido)methylidene]amino]propyl acetate (CAS 6276-57-9) is a chemical compound with molecular formula C6H12N4O4 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[amino(nitramido)methylidene]amino]propyl acetate
Also Known As: Furalazine, 3-[[amino(nitramido)methylidene]amino]propyl acetate, 3-{(E)-[Amino(nitroamino)methylidene]amino}propyl acetate
| Molecular Formula | C6H12N4O4 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 204.08586 |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 6276-57-9 |
|---|---|
| SMILES | CC(=O)OCCCN=C(N)N[N+](=O)[O-] |
| InChIKey | OWXCUSDXOPCSHR-UHFFFAOYSA-N |
Product Overview
3-[[Amino(nitramido)methylidene]amino]propyl acetate (CAS 6276-57-9), with molecular formula C6H12N4O4 and molecular weight 204.09 g/mol. IUPAC: 3-[[amino(nitramido)methylidene]amino]propyl acetate.
Chemical Property Profile of 3-[[Amino(nitramido)methylidene]amino]propyl acetate
Property Insights of 3-[[Amino(nitramido)methylidene]amino]propyl acetate
The XLogP value of -0.5 indicates that 3-[[Amino(nitramido)methylidene]amino]propyl acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[Amino(nitramido)methylidene]amino]propyl acetate. Following Lipinski's Rule of Five, 3-[[Amino(nitramido)methylidene]amino]propyl acetate has 2 hydrogen bond donor(s) and 5 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 3-[[Amino(nitramido)methylidene]amino]propyl acetate?
The CAS number of 3-[[Amino(nitramido)methylidene]amino]propyl acetate is 6276-57-9.
What is the molecular formula of 3-[[Amino(nitramido)methylidene]amino]propyl acetate?
The molecular formula of 3-[[Amino(nitramido)methylidene]amino]propyl acetate is C6H12N4O4.
What is the molecular weight of 3-[[Amino(nitramido)methylidene]amino]propyl acetate?
The molecular weight of 3-[[Amino(nitramido)methylidene]amino]propyl acetate is 204.09 g/mol.
Where can I buy 3-[[Amino(nitramido)methylidene]amino]propyl acetate?
You can request a quote for 3-[[Amino(nitramido)methylidene]amino]propyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[Amino(nitramido)methylidene]amino]propyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-[[Amino(nitramido)methylidene]amino]propyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.