BAS 00513003
TL;DR: BAS 00513003 (CAS 329208-07-3) is a chemical compound with molecular formula C20H23NO6 and molecular weight 373.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-(2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate
Also Known As: BAS 00513003, ethyl 2-amino-4-(2,4-dimethoxyphenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, ethyl 2-amino-4-(2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate, ethyl 2-amino-4-(2,4-dimethoxyphenyl)-5-oxo-4H-6,7,8-trihydrochromene-3-carbox ylate
| Molecular Formula | C20H23NO6 |
|---|---|
| Molecular Weight | 373.15 g/mol |
| LogP | 2.5581 |
| Topological Polar Surface Area | 97.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.15253 |
| Heavy Atoms | 27 |
| Complexity | 838.8737 |
Chemical Identifiers
| CAS Number | 329208-07-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C(C1C3=C(C=C(C=C3)OC)OC)C(=O)CCC2)N |
Product Overview
BAS 00513003 (CAS 329208-07-3), with molecular formula C20H23NO6 and molecular weight 373.15 g/mol. IUPAC: ethyl 2-amino-4-(2,4-dimethoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate.
Chemical Property Profile of BAS 00513003
Property Insights of BAS 00513003
The XLogP value of 2.5581 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00513003. The TPSA of 97.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00513003. Following Lipinski's Rule of Five, BAS 00513003 has 1 hydrogen bond donor(s) and 7 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 BAS 00513003?
The CAS number of BAS 00513003 is 329208-07-3.
What is the molecular formula of BAS 00513003?
The molecular formula of BAS 00513003 is C20H23NO6.
What is the molecular weight of BAS 00513003?
The molecular weight of BAS 00513003 is 373.15 g/mol.
Where can I buy BAS 00513003?
You can request a quote for BAS 00513003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00513003?
Yes, KEHONG BIO provides custom synthesis services for BAS 00513003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.