8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one
TL;DR: 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one (CAS 315237-86-6) is a chemical compound with molecular formula C27H31N3O3 and molecular weight 445.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(azepan-1-ylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol-2-yl)chromen-4-one
Also Known As: 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one, 8-(azepan-1-ylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methyl-1H-benzimidazol-2-yl)-4H-chromen-4-one, 8-(azepan-1-ylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methyl-1H-benzo[d]imidazol-2-yl)-4H-chromen-4-one, 8-(azepan-1-ylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol-2-yl)chromen-4-one, 8-(azepan-1-ylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzoimidazol-2-yl)chromen-4-one
| Molecular Formula | C27H31N3O3 |
|---|---|
| Molecular Weight | 445.24 g/mol |
| LogP | 5.29912 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.23654 |
| Heavy Atoms | 33 |
| Complexity | 1391.7592 |
Chemical Identifiers
| CAS Number | 315237-86-6 |
|---|---|
| SMILES | CCC1=CC2=C(C(=C1O)CN3CCCCCC3)OC(=C(C2=O)C4=NC5=CC=CC=C5N4C)C |
Product Overview
8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one (CAS 315237-86-6), with molecular formula C27H31N3O3 and molecular weight 445.24 g/mol. IUPAC: 8-(azepan-1-ylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol-2-yl)chromen-4-one.
Chemical Property Profile of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one
Property Insights of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one
The XLogP value of 5.29912 indicates that 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one. Following Lipinski's Rule of Five, 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one has 1 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 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one?
The CAS number of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one is 315237-86-6.
What is the molecular formula of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one?
The molecular formula of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one is C27H31N3O3.
What is the molecular weight of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one?
The molecular weight of 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one is 445.24 g/mol.
Where can I buy 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one?
You can request a quote for 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 8-(azaperhydroepinylmethyl)-6-ethyl-7-hydroxy-2-methyl-3-(1-methylbenzimidazol -2-yl)chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.