1,4-Bis-methylenimino-piperazin
TL;DR: 1,4-Bis-methylenimino-piperazin (CAS 5824-92-0) is a chemical compound with molecular formula C29H25ClN4O6S and molecular weight 592.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-5-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: 1,4-Bis-methylenimino-piperazin, BAS 00756353, Ethyl 2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-5-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (8E)-8-[[5-(2-CHLORO-4-NITRO-PHENYL)-2-FURYL]METHYLIDENE]-2-(4-DIMETHYLAMINOPHENYL)-4-METHYL-9-OXO-7-THIA-1,5-DIAZABICYCLO[4.3.0]NONA-3,5-DIENE-3-CARBOXYLATE, ethyl 2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-5-(4-dimethylaminophenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C29H25ClN4O6S |
|---|---|
| Molecular Weight | 592.12 g/mol |
| LogP | 4.6859 |
| Topological Polar Surface Area | 120.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 592.11835 |
| Heavy Atoms | 41 |
| Complexity | 1884.8905 |
Chemical Identifiers
| CAS Number | 5824-92-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(O4)C5=C(C=C(C=C5)[N+](=O)[O-])Cl)S2)C |
Product Overview
1,4-Bis-methylenimino-piperazin (CAS 5824-92-0), with molecular formula C29H25ClN4O6S and molecular weight 592.12 g/mol. IUPAC: ethyl 2-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-5-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of 1,4-Bis-methylenimino-piperazin
Property Insights of 1,4-Bis-methylenimino-piperazin
The XLogP value of 4.6859 indicates that 1,4-Bis-methylenimino-piperazin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis-methylenimino-piperazin. Following Lipinski's Rule of Five, 1,4-Bis-methylenimino-piperazin has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Bis-methylenimino-piperazin?
The CAS number of 1,4-Bis-methylenimino-piperazin is 5824-92-0.
What is the molecular formula of 1,4-Bis-methylenimino-piperazin?
The molecular formula of 1,4-Bis-methylenimino-piperazin is C29H25ClN4O6S.
What is the molecular weight of 1,4-Bis-methylenimino-piperazin?
The molecular weight of 1,4-Bis-methylenimino-piperazin is 592.12 g/mol.
Where can I buy 1,4-Bis-methylenimino-piperazin?
You can request a quote for 1,4-Bis-methylenimino-piperazin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis-methylenimino-piperazin?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis-methylenimino-piperazin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.