Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)
TL;DR: Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) (CAS 174657-62-6) is a chemical compound with molecular formula C28H29N3O6S and molecular weight 535.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-morpholin-4-ylethyl)-3-phenylpyrrolo[1,2-a]benzimidazol-2-yl]phenol;sulfuric acid
Also Known As: Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt), 4-[4-(2-morpholin-4-ylethyl)-3-phenylpyrrolo[1,2-a]benzimidazol-2-yl]phenol; sulfuric acid, Sulfuric acid--4-{4-[2-(morpholin-4-yl)ethyl]-3-phenyl-4H-pyrrolo[1,2-a][1,3]benzimidazol-2-yl}phenol (1/1), RefChem:369265
| Molecular Formula | C28H29N3O6S |
|---|---|
| Molecular Weight | 535.18 g/mol |
| LogP | 4.613 |
| Topological Polar Surface Area | 116.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 535.17773 |
| Heavy Atoms | 38 |
| Complexity | 1629.3259 |
Chemical Identifiers
| CAS Number | 174657-62-6 |
|---|---|
| SMILES | C1COCCN1CCN2C3=CC=CC=C3N4C2=C(C(=C4)C5=CC=C(C=C5)O)C6=CC=CC=C6.OS(=O)(=O)O |
Product Overview
Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) (CAS 174657-62-6), with molecular formula C28H29N3O6S and molecular weight 535.18 g/mol. IUPAC: 4-[4-(2-morpholin-4-ylethyl)-3-phenylpyrrolo[1,2-a]benzimidazol-2-yl]phenol;sulfuric acid.
Chemical Property Profile of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)
Property Insights of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)
The XLogP value of 4.613 indicates that Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt). Following Lipinski's Rule of Five, Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)?
The CAS number of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) is 174657-62-6.
What is the molecular formula of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)?
The molecular formula of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) is C28H29N3O6S.
What is the molecular weight of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)?
The molecular weight of Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) is 535.18 g/mol.
Where can I buy Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)?
You can request a quote for Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt)?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-(4-(2-(4-morpholinyl)ethyl)-3-phenyl-4H-pyrrolo(1,2-a)benzimidazol-2-yl)-, sulfate (1:1) (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.