A1055/0049462
TL;DR: A1055/0049462 (CAS 296770-25-7) is a chemical compound with molecular formula C22H13N3O4 and molecular weight 383.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-dioxoisoindole-5-carboxylic acid
Also Known As: A1055/0049462, 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-dioxoisoindole-5-carboxylic acid, 2-(4-(1H-benzo[d]imidazol-2-yl)phenyl)-1,3-dioxoisoindoline-5-carboxylic acid, 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid, 2-[4-(1H-1,3-BENZODIAZOL-2-YL)PHENYL]-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID
| Molecular Formula | C22H13N3O4 |
|---|---|
| Molecular Weight | 383.09 g/mol |
| LogP | 3.7287 |
| Topological Polar Surface Area | 103.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.0906 |
| Heavy Atoms | 29 |
| Complexity | 1288.6573 |
Chemical Identifiers
| CAS Number | 296770-25-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)O |
Product Overview
A1055/0049462 (CAS 296770-25-7), with molecular formula C22H13N3O4 and molecular weight 383.09 g/mol. IUPAC: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-dioxoisoindole-5-carboxylic acid.
Chemical Property Profile of A1055/0049462
Property Insights of A1055/0049462
The XLogP value of 3.7287 indicates that A1055/0049462 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.36 Ų falls within the moderate polarity range, balancing permeability and solubility for A1055/0049462. Following Lipinski's Rule of Five, A1055/0049462 has 2 hydrogen bond donor(s) and 4 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 A1055/0049462?
The CAS number of A1055/0049462 is 296770-25-7.
What is the molecular formula of A1055/0049462?
The molecular formula of A1055/0049462 is C22H13N3O4.
What is the molecular weight of A1055/0049462?
The molecular weight of A1055/0049462 is 383.09 g/mol.
Where can I buy A1055/0049462?
You can request a quote for A1055/0049462 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1055/0049462?
Yes, KEHONG BIO provides custom synthesis services for A1055/0049462 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.