BAS 00989741
TL;DR: BAS 00989741 (CAS 303189-40-4) is a chemical compound with molecular formula C22H27NO6 and molecular weight 401.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-(2,5-dimethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate
Also Known As: BAS 00989741, ethyl 2-amino-4-(2,5-dimethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate, ethyl 2-amino-4-(2,5-dimethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate
| Molecular Formula | C22H27NO6 |
|---|---|
| Molecular Weight | 401.18 g/mol |
| LogP | 3.1942 |
| Topological Polar Surface Area | 97.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.18384 |
| Heavy Atoms | 29 |
| Complexity | 911.8776 |
Chemical Identifiers
| CAS Number | 303189-40-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C(C1C3=C(C=CC(=C3)OC)OC)C(=O)CC(C2)(C)C)N |
Product Overview
BAS 00989741 (CAS 303189-40-4), with molecular formula C22H27NO6 and molecular weight 401.18 g/mol. IUPAC: ethyl 2-amino-4-(2,5-dimethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate.
Chemical Property Profile of BAS 00989741
Property Insights of BAS 00989741
The XLogP value of 3.1942 indicates that BAS 00989741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00989741. Following Lipinski's Rule of Five, BAS 00989741 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 00989741?
The CAS number of BAS 00989741 is 303189-40-4.
What is the molecular formula of BAS 00989741?
The molecular formula of BAS 00989741 is C22H27NO6.
What is the molecular weight of BAS 00989741?
The molecular weight of BAS 00989741 is 401.18 g/mol.
Where can I buy BAS 00989741?
You can request a quote for BAS 00989741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00989741?
Yes, KEHONG BIO provides custom synthesis services for BAS 00989741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.