methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate
TL;DR: methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate (CAS 902323-97-1) is a chemical compound with molecular formula C21H18ClNO6 and molecular weight 415.08228 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]benzoate
Also Known As: methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate, Methyl 4-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]benzoate, methyl 4-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]benzoate, methyl 4-{[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]amino}benzoate
Technical Specifications
| Molecular Formula | C21H18ClNO6 |
| Molecular Weight | 415.08228 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.08228 Da |
| Heavy Atoms | 29 |
| Complexity | 685.0 |
| SMILES | CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)NC3=CC=C(C=C3)C(=O)OC |
| InChIKey | RGABCVGJXOLVQX-UHFFFAOYSA-N |
Chemical Property Profile of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate
Property Insights of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate
The XLogP value of 3.1 indicates that methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate. Following Lipinski's Rule of Five, methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate 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
What is the CAS number of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate?
The CAS number of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate is 902323-97-1.
What is the molecular formula of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate?
The molecular formula of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate is C21H18ClNO6.
What is the molecular weight of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate?
The molecular weight of methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate is 415.08228 g/mol.
Where can I buy methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate?
You can request a quote for methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate?
Yes, CoreyChem provides custom synthesis services for methyl 4-(2-(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.