1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)
TL;DR: 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) (CAS 174657-70-6) is a chemical compound with molecular formula C28H29N3O7S and molecular weight 551.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-morpholin-4-ylethyl)-2-phenylpyrrolo[1,2-a]benzimidazol-3-yl]benzene-1,2-diol;sulfuric acid
Also Known As: 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt), 4-[4-(2-morpholin-4-ylethyl)-2-phenylpyrrolo[1,2-a]benzimidazol-3-yl]benzene-1,2-diol; sulfuric acid, Sulfuric acid--4-{4-[2-(morpholin-4-yl)ethyl]-2-phenyl-4H-pyrrolo[1,2-a][1,3]benzimidazol-3-yl}benzene-1,2-diol (1/1), RefChem:215525
| Molecular Formula | C28H29N3O7S |
|---|---|
| Molecular Weight | 551.17 g/mol |
| LogP | 4.3186 |
| Topological Polar Surface Area | 136.87 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 551.1726 |
| Heavy Atoms | 39 |
| Complexity | 1697.9255 |
Chemical Identifiers
| CAS Number | 174657-70-6 |
|---|---|
| SMILES | C1COCCN1CCN2C3=CC=CC=C3N4C2=C(C(=C4)C5=CC=CC=C5)C6=CC(=C(C=C6)O)O.OS(=O)(=O)O |
Product Overview
1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) (CAS 174657-70-6), with molecular formula C28H29N3O7S and molecular weight 551.17 g/mol. IUPAC: 4-[4-(2-morpholin-4-ylethyl)-2-phenylpyrrolo[1,2-a]benzimidazol-3-yl]benzene-1,2-diol;sulfuric acid.
Chemical Property Profile of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)
Property Insights of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)
The XLogP value of 4.3186 indicates that 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt). Following Lipinski's Rule of Five, 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)?
The CAS number of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) is 174657-70-6.
What is the molecular formula of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)?
The molecular formula of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) is C28H29N3O7S.
What is the molecular weight of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)?
The molecular weight of 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) is 551.17 g/mol.
Where can I buy 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)?
You can request a quote for 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-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 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt)?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzenediol, 4-(4-(2-(4-morpholinyl)ethyl)-2-phenyl-4H-pyrrolo(1,2-a)benimidazol-3-yl)-, sulfate (1:1) (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.