Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide
TL;DR: Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide (CAS 60723-95-7) is a chemical compound with molecular formula C21H30BrClN2O4 and molecular weight 488.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chloro-5-methyl-2-propan-2-ylphenoxy)butyl-dimethyl-[(5-nitrofuran-2-yl)methyl]azanium bromide
Also Known As: (4-(6-Chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)ammonium bromide, AMMONIUM, (4-(6-CHLOROTHYMYLOXY)BUTYL)DIMETHYL(5-NITRO-2-FURFURYL)-, BROMIDE, 4-(4-chloro-5-methyl-2-propan-2-ylphenoxy)butyl-dimethyl-[(5-nitrofuran-2-yl)methyl]azanium bromide, 4-[4-Chloro-5-methyl-2-(propan-2-yl)phenoxy]-N,N-dimethyl-N-[(5-nitrofuran-2-yl)methyl]butan-1-aminium bromide, RefChem:318906
| Molecular Formula | C21H30BrClN2O4 |
|---|---|
| Molecular Weight | 488.11 g/mol |
| LogP | 2.71 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 488.10776 |
| Heavy Atoms | 29 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 60723-95-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OCCCC[N+](C)(C)CC2=CC=C(O2)[N+](=O)[O-].[Br-] |
| InChIKey | JSUYRNUGISWJMY-UHFFFAOYSA-M |
Product Overview
Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide (CAS 60723-95-7), with molecular formula C21H30BrClN2O4 and molecular weight 488.11 g/mol. IUPAC: 4-(4-chloro-5-methyl-2-propan-2-ylphenoxy)butyl-dimethyl-[(5-nitrofuran-2-yl)methyl]azanium bromide.
Chemical Property Profile of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide
Property Insights of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide
The XLogP value of 2.71 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide. Following Lipinski's Rule of Five, Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide has 0 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 Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide?
The CAS number of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide is 60723-95-7.
What is the molecular formula of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide?
The molecular formula of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide is C21H30BrClN2O4.
What is the molecular weight of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide?
The molecular weight of Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide is 488.11 g/mol.
Where can I buy Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide?
You can request a quote for Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (4-(6-chlorothymyloxy)butyl)dimethyl(5-nitro-2-furfuryl)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.