Bionet1_003013
TL;DR: Bionet1_003013 (CAS 341966-05-0) is a chemical compound with molecular formula C18H17ClN2O5 and molecular weight 376.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(3-chlorobenzoyl)amino]-2-[2-(dimethylamino)ethenyl]-6-oxopyran-3-carboxylate
Also Known As: Bionet1_003013, methyl 5-[(3-chlorobenzoyl)amino]-2-[2-(dimethylamino)ethenyl]-6-oxopyran-3-carboxylate, methyl 3-[(3-chlorobenzoyl)amino]-6-[(E)-2-(dimethylamino)ethenyl]-2-oxo-2H-pyran-5-carboxylate, Methyl 3-(3-chlorobenzamido)-6-[2-(dimethylamino)ethenyl]-2-oxo-2H-pyran-5-carboxylate, methyl 3-[(3-chlorobenzoyl)amino]-6-[2-(dimethylamino)ethenyl]-2-oxo-2H-pyran-5-carboxylate
| Molecular Formula | C18H17ClN2O5 |
|---|---|
| Molecular Weight | 376.08 g/mol |
| LogP | 2.8644 |
| Topological Polar Surface Area | 88.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.0826 |
| Heavy Atoms | 26 |
| Complexity | 918.0377 |
Chemical Identifiers
| CAS Number | 341966-05-0 |
|---|---|
| SMILES | CN(C)C=CC1=C(C=C(C(=O)O1)NC(=O)C2=CC(=CC=C2)Cl)C(=O)OC |
Product Overview
Bionet1_003013 (CAS 341966-05-0), with molecular formula C18H17ClN2O5 and molecular weight 376.08 g/mol. IUPAC: methyl 5-[(3-chlorobenzoyl)amino]-2-[2-(dimethylamino)ethenyl]-6-oxopyran-3-carboxylate.
Chemical Property Profile of Bionet1_003013
Property Insights of Bionet1_003013
The XLogP value of 2.8644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_003013. The TPSA of 88.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_003013. Following Lipinski's Rule of Five, Bionet1_003013 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 Bionet1_003013?
The CAS number of Bionet1_003013 is 341966-05-0.
What is the molecular formula of Bionet1_003013?
The molecular formula of Bionet1_003013 is C18H17ClN2O5.
What is the molecular weight of Bionet1_003013?
The molecular weight of Bionet1_003013 is 376.08 g/mol.
Where can I buy Bionet1_003013?
You can request a quote for Bionet1_003013 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_003013?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_003013 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.