C17H15Cl2NO4
TL;DR: C17H15Cl2NO4 (CAS 489462-97-7) is a chemical compound with molecular formula C17H15Cl2NO4 and molecular weight 367.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-4-(2,4-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate
Also Known As: AB01278464-01, methyl 2-amino-4-(2,4-dichlorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, methyl 2-amino-4-(2,4-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate
| Molecular Formula | C17H15Cl2NO4 |
|---|---|
| Molecular Weight | 367.04 g/mol |
| LogP | 3.4576 |
| Topological Polar Surface Area | 78.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 367.0378 |
| Heavy Atoms | 24 |
| Complexity | 797.78033 |
Chemical Identifiers
| CAS Number | 489462-97-7 |
|---|---|
| SMILES | COC(=O)C1=C(OC2=C(C1C3=C(C=C(C=C3)Cl)Cl)C(=O)CCC2)N |
Product Overview
C17H15Cl2NO4 (CAS 489462-97-7), with molecular formula C17H15Cl2NO4 and molecular weight 367.04 g/mol. IUPAC: methyl 2-amino-4-(2,4-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate.
Chemical Property Profile of C17H15Cl2NO4
Property Insights of C17H15Cl2NO4
The XLogP value of 3.4576 indicates that C17H15Cl2NO4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.62 Ų falls within the moderate polarity range, balancing permeability and solubility for C17H15Cl2NO4. Following Lipinski's Rule of Five, C17H15Cl2NO4 has 1 hydrogen bond donor(s) and 5 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 C17H15Cl2NO4?
The CAS number of C17H15Cl2NO4 is 489462-97-7.
What is the molecular formula of C17H15Cl2NO4?
The molecular formula of C17H15Cl2NO4 is C17H15Cl2NO4.
What is the molecular weight of C17H15Cl2NO4?
The molecular weight of C17H15Cl2NO4 is 367.04 g/mol.
Where can I buy C17H15Cl2NO4?
You can request a quote for C17H15Cl2NO4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H15Cl2NO4?
Yes, KEHONG BIO provides custom synthesis services for C17H15Cl2NO4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.