AB00672819-01
TL;DR: AB00672819-01 (CAS 477568-15-3) is a chemical compound with molecular formula C22H17NO5S and molecular weight 407.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-methyl-5-[(3-oxobenzo[f]chromene-2-carbonyl)amino]thiophene-2-carboxylate
Also Known As: AB00672819-01, F0882-0846, ethyl 3-methyl-5-{3-oxo-3H-benzo[f]chromene-2-amido}thiophene-2-carboxylate, ethyl 3-methyl-5-(3-oxo-3H-benzo[f]chromene-2-carboxamido)thiophene-2-carboxylate, ethyl 3-methyl-5-[(3-oxobenzo[f]chromene-2-carbonyl)amino]thiophene-2-carboxylate
| Molecular Formula | C22H17NO5S |
|---|---|
| Molecular Weight | 407.08 g/mol |
| LogP | 4.74512 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.08273 |
| Heavy Atoms | 29 |
| Complexity | 1318.0297 |
Chemical Identifiers
| CAS Number | 477568-15-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=O)C |
Product Overview
AB00672819-01 (CAS 477568-15-3), with molecular formula C22H17NO5S and molecular weight 407.08 g/mol. IUPAC: ethyl 3-methyl-5-[(3-oxobenzo[f]chromene-2-carbonyl)amino]thiophene-2-carboxylate.
Chemical Property Profile of AB00672819-01
Property Insights of AB00672819-01
The XLogP value of 4.74512 indicates that AB00672819-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672819-01. Following Lipinski's Rule of Five, AB00672819-01 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 AB00672819-01?
The CAS number of AB00672819-01 is 477568-15-3.
What is the molecular formula of AB00672819-01?
The molecular formula of AB00672819-01 is C22H17NO5S.
What is the molecular weight of AB00672819-01?
The molecular weight of AB00672819-01 is 407.08 g/mol.
Where can I buy AB00672819-01?
You can request a quote for AB00672819-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672819-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672819-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.