3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one
TL;DR: 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one (CAS 579444-01-2) is a chemical compound with molecular formula C23H24ClNO3 and molecular weight 397.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)chromen-2-one
Also Known As: EiM07-14678, 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one, 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(1-piperidylmethyl)chromen-2-one, 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)chromen-2-one, 3-BENZYL-6-CHLORO-7-HYDROXY-4-METHYL-8-[(PIPERIDIN-1-YL)METHYL]-2H-CHROMEN-2-ONE
| Molecular Formula | C23H24ClNO3 |
|---|---|
| Molecular Weight | 397.14 g/mol |
| LogP | 5.03712 |
| Topological Polar Surface Area | 53.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.14447 |
| Heavy Atoms | 28 |
| Complexity | 1053.1158 |
Chemical Identifiers
| CAS Number | 579444-01-2 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)CN3CCCCC3)CC4=CC=CC=C4 |
Product Overview
3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one (CAS 579444-01-2), with molecular formula C23H24ClNO3 and molecular weight 397.14 g/mol. IUPAC: 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)chromen-2-one.
Chemical Property Profile of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one
Property Insights of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one
The XLogP value of 5.03712 indicates that 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-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, 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one?
The CAS number of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one is 579444-01-2.
What is the molecular formula of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one?
The molecular formula of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one is C23H24ClNO3.
What is the molecular weight of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one?
The molecular weight of 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one is 397.14 g/mol.
Where can I buy 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one?
You can request a quote for 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-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 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-benzyl-6-chloro-7-hydroxy-4-methyl-8-(piperidin-1-ylmethyl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.