6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
TL;DR: 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one (CAS 861147-34-4) is a chemical compound with molecular formula C18H21ClN4O3 and molecular weight 376.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-hexyl-4-methyl-7-(2H-tetrazol-5-ylmethoxy)chromen-2-one
Also Known As: EiM07-19282, 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one, 6-chloro-3-hexyl-4-methyl-7-(2H-tetrazol-5-ylmethoxy)chromen-2-one, 7-((2H-tetrazol-5-yl)methoxy)-6-chloro-3-hexyl-4-methyl-2H-chromen-2-one, 6-CHLORO-3-HEXYL-4-METHYL-7-[(1H-1,2,3,4-TETRAZOL-5-YL)METHOXY]-2H-CHROMEN-2-ONE
| Molecular Formula | C18H21ClN4O3 |
|---|---|
| Molecular Weight | 376.13 g/mol |
| LogP | 3.96972 |
| Topological Polar Surface Area | 93.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 376.13022 |
| Heavy Atoms | 26 |
| Complexity | 937.74945 |
Chemical Identifiers
| CAS Number | 861147-34-4 |
|---|---|
| SMILES | CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=NNN=N3)Cl)C |
Product Overview
6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one (CAS 861147-34-4), with molecular formula C18H21ClN4O3 and molecular weight 376.13 g/mol. IUPAC: 6-chloro-3-hexyl-4-methyl-7-(2H-tetrazol-5-ylmethoxy)chromen-2-one.
Chemical Property Profile of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
Property Insights of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one
The XLogP value of 3.96972 indicates that 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one. Following Lipinski's Rule of Five, 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one has 1 hydrogen bond donor(s) and 6 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 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
The CAS number of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is 861147-34-4.
What is the molecular formula of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
The molecular formula of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is C18H21ClN4O3.
What is the molecular weight of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
The molecular weight of 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one is 376.13 g/mol.
Where can I buy 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
You can request a quote for 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-3-hexyl-4-methyl-7-(1H-tetrazol-5-ylmethoxy)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.