![4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one structure](/static/products/5869/586991-87-9.webp)
4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one
TL;DR: 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one (CAS 586991-87-9) is a chemical compound with molecular formula C16H20ClNO3 and molecular weight 309.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxychromen-2-one
Also Known As: EiM07-16775, 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one, 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-coumarin, 4-butyl-6-chloro-8-(dimethylaminomethyl)-7-hydroxychromen-2-one, 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxychromen-2-one
| Molecular Formula | C16H20ClNO3 |
|---|---|
| Molecular Weight | 309.11 g/mol |
| LogP | 3.5562 |
| Topological Polar Surface Area | 53.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 309.11316 |
| Heavy Atoms | 21 |
| Complexity | 706.7148 |
Chemical Identifiers
| CAS Number | 586991-87-9 |
|---|---|
| SMILES | CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)CN(C)C |
Product Overview
4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one (CAS 586991-87-9), with molecular formula C16H20ClNO3 and molecular weight 309.11 g/mol. IUPAC: 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxychromen-2-one.
Chemical Property Profile of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one
Property Insights of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one
The XLogP value of 3.5562 indicates that 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.68 Ų, 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one has 1 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 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one?
The CAS number of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one is 586991-87-9.
What is the molecular formula of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one?
The molecular formula of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one is C16H20ClNO3.
What is the molecular weight of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one?
The molecular weight of 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one is 309.11 g/mol.
Where can I buy 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one?
You can request a quote for 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-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 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-butyl-6-chloro-8-[(dimethylamino)methyl]-7-hydroxy-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.