C12H18N5O4.Br
TL;DR: C12H18N5O4.Br (CAS 37386-05-3) is a chemical compound with molecular formula C12H18BrN5O4 and molecular weight 375.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-aminopiperidin-1-ium-1-yl)-N-[(5-nitrofuran-2-yl)methylideneamino]acetamide bromide
Also Known As: 5-Nitro-2-furaldehyde N-amino-N-acethydrazone piperidinium bromide, Piperidinium, amino(((5-nitrofurfurylidene)hydrazino)carbonylmethyl)-, bromide, Piperidinium, 1-amino-1-[2-[[(5-nitro-2-furanyl)methylene]hydrazino]-2-oxoethyl]-, bromide
| Molecular Formula | C12H18BrN5O4 |
|---|---|
| Molecular Weight | 375.05 g/mol |
| LogP | -2.4837 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.05423 |
| Heavy Atoms | 22 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 37386-05-3 |
|---|---|
| SMILES | C1CC[N+](CC1)(CC(=O)NN=CC2=CC=C(O2)[N+](=O)[O-])N.[Br-] |
| InChIKey | JAQISFIGDBCCGQ-UHFFFAOYSA-N |
Product Overview
C12H18N5O4.Br (CAS 37386-05-3), with molecular formula C12H18BrN5O4 and molecular weight 375.05 g/mol. IUPAC: 2-(1-aminopiperidin-1-ium-1-yl)-N-[(5-nitrofuran-2-yl)methylideneamino]acetamide bromide.
Chemical Property Profile of C12H18N5O4.Br
Property Insights of C12H18N5O4.Br
The XLogP value of -2.4837 indicates that C12H18N5O4.Br is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C12H18N5O4.Br. Following Lipinski's Rule of Five, C12H18N5O4.Br has 2 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 C12H18N5O4.Br?
The CAS number of C12H18N5O4.Br is 37386-05-3.
What is the molecular formula of C12H18N5O4.Br?
The molecular formula of C12H18N5O4.Br is C12H18BrN5O4.
What is the molecular weight of C12H18N5O4.Br?
The molecular weight of C12H18N5O4.Br is 375.05 g/mol.
Where can I buy C12H18N5O4.Br?
You can request a quote for C12H18N5O4.Br directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C12H18N5O4.Br?
Yes, KEHONG BIO provides custom synthesis services for C12H18N5O4.Br and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.