4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)
TL;DR: 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) (CAS 174657-48-8) is a chemical compound with molecular formula C28H31N3O4S and molecular weight 505.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-diphenylpyrrolo[1,2-a]benzimidazol-4-yl)-N,N-diethylethanamine;sulfuric acid
Also Known As: 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1), N,N-Diethyl-2,3-diphenyl-4H-pyrrolo(1,2-a)benzimidazole-4-ethanamine sulfate (1:1), 2-(2,3-diphenylpyrrolo[1,2-a]benzimidazol-4-yl)-N,N-diethylethanamine; sulfuric acid, Sulfuric acid--2-(2,3-diphenyl-4H-pyrrolo[1,2-a][1,3]benzimidazol-4-yl)-N,N-diethylethan-1-amine (1/1), RefChem:297881
| Molecular Formula | C28H31N3O4S |
|---|---|
| Molecular Weight | 505.20 g/mol |
| LogP | 5.917 |
| Topological Polar Surface Area | 87.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 505.20352 |
| Heavy Atoms | 36 |
| Complexity | 1529.8427 |
Chemical Identifiers
| CAS Number | 174657-48-8 |
|---|---|
| SMILES | CCN(CC)CCN1C2=CC=CC=C2N3C1=C(C(=C3)C4=CC=CC=C4)C5=CC=CC=C5.OS(=O)(=O)O |
Product Overview
4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) (CAS 174657-48-8), with molecular formula C28H31N3O4S and molecular weight 505.20 g/mol. IUPAC: 2-(2,3-diphenylpyrrolo[1,2-a]benzimidazol-4-yl)-N,N-diethylethanamine;sulfuric acid.
Chemical Property Profile of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)
Property Insights of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)
The XLogP value of 5.917 indicates that 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1). Following Lipinski's Rule of Five, 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)?
The CAS number of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) is 174657-48-8.
What is the molecular formula of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)?
The molecular formula of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) is C28H31N3O4S.
What is the molecular weight of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)?
The molecular weight of 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) is 505.20 g/mol.
Where can I buy 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)?
You can request a quote for 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 4H-Pyrrolo(1,2-a)benzimidazole-4-ethanamine, N,N-diethyl-2,3-diphenyl-, sulfate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.