BAS 00673965
TL;DR: BAS 00673965 (CAS 303136-26-7) is a chemical compound with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxyphenyl] acetate
Also Known As: BAS 00673965, 4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-methoxyphenyl acetate, AB00094664-01, [4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxyphenyl] acetate, 4-(2-amino-3-cyano-7,7-dimethyl-5-oxo(4H-6,7,8-trihydrochromen-4-yl))-2-methox yphenyl acetate
| Molecular Formula | C21H22N2O5 |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | 3.07138 |
| Topological Polar Surface Area | 111.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.15286 |
| Heavy Atoms | 28 |
| Complexity | 965.4983 |
Chemical Identifiers
| CAS Number | 303136-26-7 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)OC |
Product Overview
BAS 00673965 (CAS 303136-26-7), with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol. IUPAC: [4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxyphenyl] acetate.
Chemical Property Profile of BAS 00673965
Property Insights of BAS 00673965
The XLogP value of 3.07138 indicates that BAS 00673965 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00673965. Following Lipinski's Rule of Five, BAS 00673965 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 00673965?
The CAS number of BAS 00673965 is 303136-26-7.
What is the molecular formula of BAS 00673965?
The molecular formula of BAS 00673965 is C21H22N2O5.
What is the molecular weight of BAS 00673965?
The molecular weight of BAS 00673965 is 382.15 g/mol.
Where can I buy BAS 00673965?
You can request a quote for BAS 00673965 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00673965?
Yes, KEHONG BIO provides custom synthesis services for BAS 00673965 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.