RefChem:377705
TL;DR: RefChem:377705 (CAS 79513-44-3) is a chemical compound with molecular formula C21H30N4O9 and molecular weight 482.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-(8-methoxy-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-1-yl)ethanamine;oxalic acid
Also Known As: Pyrimido(1,2-a)benzimidazole, 1,2,3,4-tetrahydro-1-(2-(diethylamino)ethyl)-8-methoxy-, bisoxalate, N,N-diethyl-2-(8-methoxy-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-1-yl)ethanamine; oxalic acid, N,N-diethyl-2-(8-methoxy-3,4-dihydro-2H-pyrimido[3,2-a]benzimidazol-1-yl)ethanamine; oxalic acid, Oxalic acid--N,N-diethyl-2-(8-methoxy-3,4-dihydropyrimido[1,2-a][1,3]benzimidazol-1(2H)-yl)ethan-1-amine (2/1), RefChem:377705
| Molecular Formula | C21H30N4O9 |
|---|---|
| Molecular Weight | 482.20 g/mol |
| LogP | 0.908 |
| Topological Polar Surface Area | 182.73 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 482.20126 |
| Heavy Atoms | 34 |
| Complexity | 953.53564 |
Chemical Identifiers
| CAS Number | 79513-44-3 |
|---|---|
| SMILES | CCN(CC)CCN1CCCN2C1=NC3=C2C=CC(=C3)OC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O |
Product Overview
RefChem:377705 (CAS 79513-44-3), with molecular formula C21H30N4O9 and molecular weight 482.20 g/mol. IUPAC: N,N-diethyl-2-(8-methoxy-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-1-yl)ethanamine;oxalic acid.
Chemical Property Profile of RefChem:377705
Property Insights of RefChem:377705
The XLogP value of 0.908 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:377705. The TPSA of 182.73 Ų indicates high polarity, suggesting RefChem:377705 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:377705 has 4 hydrogen bond donor(s) and 8 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 RefChem:377705?
The CAS number of RefChem:377705 is 79513-44-3.
What is the molecular formula of RefChem:377705?
The molecular formula of RefChem:377705 is C21H30N4O9.
What is the molecular weight of RefChem:377705?
The molecular weight of RefChem:377705 is 482.20 g/mol.
Where can I buy RefChem:377705?
You can request a quote for RefChem:377705 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:377705?
Yes, KEHONG BIO provides custom synthesis services for RefChem:377705 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.