Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate
TL;DR: Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate (CAS 92019-79-9) is a chemical compound with molecular formula C20H22ClN4O3P and molecular weight 432.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2-[(1-benzyl-4,5-dihydroimidazol-2-yl)oxy-chlorophosphoryl]oxy-4,5-dihydroimidazole
Also Known As: bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate, 1-benzyl-2-[(1-benzyl-4,5-dihydroimidazol-2-yl)oxy-chlorophosphoryl]oxy-4,5-dihydroimidazole, trans-2,5-Bis-(toluol-4-sulfonyloxymethyl)-[1,4]dioxan, 1-benzyl-2-[(1-benzyl-4,5-dihydroimidazol-2-yl)oxy-chloropho, Phosphorochloridicacid, bis[4,5-dihydro-1-(phenylmethyl)-1H-imidazol-2-yl] ester (9CI)
| Molecular Formula | C20H22ClN4O3P |
|---|---|
| Molecular Weight | 432.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 432.11182 |
| Heavy Atoms | 29 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 92019-79-9 |
|---|---|
| SMILES | C1CN(C(=N1)OP(=O)(OC2=NCCN2CC3=CC=CC=C3)Cl)CC4=CC=CC=C4 |
| InChIKey | MMBRATGGMDFQKE-UHFFFAOYSA-N |
Product Overview
Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate (CAS 92019-79-9), with molecular formula C20H22ClN4O3P and molecular weight 432.11 g/mol. IUPAC: 1-benzyl-2-[(1-benzyl-4,5-dihydroimidazol-2-yl)oxy-chlorophosphoryl]oxy-4,5-dihydroimidazole.
Chemical Property Profile of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate
Property Insights of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate. The TPSA of 66.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate. Following Lipinski's Rule of Five, Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate 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 Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate?
The CAS number of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate is 92019-79-9.
What is the molecular formula of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate?
The molecular formula of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate is C20H22ClN4O3P.
What is the molecular weight of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate?
The molecular weight of Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate is 432.11 g/mol.
Where can I buy Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate?
You can request a quote for Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate?
Yes, KEHONG BIO provides custom synthesis services for Bis(1-benzyl-4,5-dihydro-1h-imidazol-2-yl) phosphorochloridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.