BAS 00818530
TL;DR: BAS 00818530 (CAS 332024-47-2) is a chemical compound with molecular formula C24H28N2O3S and molecular weight 424.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanylacetate
Also Known As: BAS 00818530, ethyl 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanylacetate, ethyl {[3-allyl-4-oxo-3,4,5,6-tetrahydrospiro(benzo[h]quinazoline-5,1'-cyclohexane)-2-yl]sulfanyl}acetate, ethyl {[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetate, ethyl 2-((3-allyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)thio)acetate
| Molecular Formula | C24H28N2O3S |
|---|---|
| Molecular Weight | 424.18 g/mol |
| LogP | 4.5095 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.18207 |
| Heavy Atoms | 30 |
| Complexity | 1021.5965 |
Chemical Identifiers
| CAS Number | 332024-47-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C(=O)N1CC=C)C3(CCCCC3)CC4=CC=CC=C42 |
Product Overview
BAS 00818530 (CAS 332024-47-2), with molecular formula C24H28N2O3S and molecular weight 424.18 g/mol. IUPAC: ethyl 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanylacetate.
Chemical Property Profile of BAS 00818530
Property Insights of BAS 00818530
The XLogP value of 4.5095 indicates that BAS 00818530 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00818530. Following Lipinski's Rule of Five, BAS 00818530 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 00818530?
The CAS number of BAS 00818530 is 332024-47-2.
What is the molecular formula of BAS 00818530?
The molecular formula of BAS 00818530 is C24H28N2O3S.
What is the molecular weight of BAS 00818530?
The molecular weight of BAS 00818530 is 424.18 g/mol.
Where can I buy BAS 00818530?
You can request a quote for BAS 00818530 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00818530?
Yes, KEHONG BIO provides custom synthesis services for BAS 00818530 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.