BAS 00288808
TL;DR: BAS 00288808 (CAS 330819-53-9) is a chemical compound with molecular formula C22H23ClN2O3 and molecular weight 398.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(4-chlorophenyl)-2-oxoethoxy]-3,3-dimethyl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile
Also Known As: BAS 00288808, 6-(2-(4-chlorophenyl)-2-oxoethoxy)-3,3-dimethyl-8-propyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile, 6-[2-(4-chlorophenyl)-2-oxoethoxy]-3,3-dimethyl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile, 6-[2-(4-chlorophenyl)-2-oxoethoxy]-3,3-dimethyl-8-propyl-3,4-dihydro-1H-pyrano [3,4-c]pyridine-5-carbonitrile, 6-[2-(4-chlorophenyl)-2-oxoethoxy]-3,3-dimethyl-8-propyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
| Molecular Formula | C22H23ClN2O3 |
|---|---|
| Molecular Weight | 398.14 g/mol |
| LogP | 4.67218 |
| Topological Polar Surface Area | 72.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1397 |
| Heavy Atoms | 28 |
| Complexity | 930.27856 |
Chemical Identifiers
| CAS Number | 330819-53-9 |
|---|---|
| SMILES | CCCC1=NC(=C(C2=C1COC(C2)(C)C)C#N)OCC(=O)C3=CC=C(C=C3)Cl |
Product Overview
BAS 00288808 (CAS 330819-53-9), with molecular formula C22H23ClN2O3 and molecular weight 398.14 g/mol. IUPAC: 6-[2-(4-chlorophenyl)-2-oxoethoxy]-3,3-dimethyl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile.
Chemical Property Profile of BAS 00288808
Property Insights of BAS 00288808
The XLogP value of 4.67218 indicates that BAS 00288808 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00288808. Following Lipinski's Rule of Five, BAS 00288808 has 0 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 BAS 00288808?
The CAS number of BAS 00288808 is 330819-53-9.
What is the molecular formula of BAS 00288808?
The molecular formula of BAS 00288808 is C22H23ClN2O3.
What is the molecular weight of BAS 00288808?
The molecular weight of BAS 00288808 is 398.14 g/mol.
Where can I buy BAS 00288808?
You can request a quote for BAS 00288808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00288808?
Yes, KEHONG BIO provides custom synthesis services for BAS 00288808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.