3-(1H-benzimidazol-2-yl)chromen-2-imine
TL;DR: 3-(1H-benzimidazol-2-yl)chromen-2-imine (CAS 80860-16-8) is a chemical compound with molecular formula C16H11N3O and molecular weight 261.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-benzimidazol-2-yl)chromen-2-imine
Also Known As: 3-(1H-benzimidazol-2-yl)chromen-2-imine, 3-(1H-Benzimidazol-2-yl)-2H-chromen-2-imine, 3-(2-benzimidazolyl)-2-iminochromene, NCI60_030554, 3-(1H-Benzoimidazol-2-yl)-chromen-2-ylideneamine
| Molecular Formula | C16H11N3O |
|---|---|
| Molecular Weight | 261.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.0902 |
| Heavy Atoms | 20 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 80860-16-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=N)O2)C3=NC4=CC=CC=C4N3 |
| InChIKey | FNEFMQFIPIXXNV-UHFFFAOYSA-N |
Product Overview
3-(1H-benzimidazol-2-yl)chromen-2-imine (CAS 80860-16-8), with molecular formula C16H11N3O and molecular weight 261.09 g/mol. IUPAC: 3-(1H-benzimidazol-2-yl)chromen-2-imine.
Chemical Property Profile of 3-(1H-benzimidazol-2-yl)chromen-2-imine
Property Insights of 3-(1H-benzimidazol-2-yl)chromen-2-imine
The XLogP value of 3.2 indicates that 3-(1H-benzimidazol-2-yl)chromen-2-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1H-benzimidazol-2-yl)chromen-2-imine. Following Lipinski's Rule of Five, 3-(1H-benzimidazol-2-yl)chromen-2-imine has 2 hydrogen bond donor(s) and 3 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 3-(1H-benzimidazol-2-yl)chromen-2-imine?
The CAS number of 3-(1H-benzimidazol-2-yl)chromen-2-imine is 80860-16-8.
What is the molecular formula of 3-(1H-benzimidazol-2-yl)chromen-2-imine?
The molecular formula of 3-(1H-benzimidazol-2-yl)chromen-2-imine is C16H11N3O.
What is the molecular weight of 3-(1H-benzimidazol-2-yl)chromen-2-imine?
The molecular weight of 3-(1H-benzimidazol-2-yl)chromen-2-imine is 261.09 g/mol.
Where can I buy 3-(1H-benzimidazol-2-yl)chromen-2-imine?
You can request a quote for 3-(1H-benzimidazol-2-yl)chromen-2-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-benzimidazol-2-yl)chromen-2-imine?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-benzimidazol-2-yl)chromen-2-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.