BAS 01322123
TL;DR: BAS 01322123 (CAS 337494-97-0) is a chemical compound with molecular formula C26H28N2OS and molecular weight 416.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2-(2-phenylethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: BAS 01322123, 3-ethyl-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one, 3-ethyl-2-(phenethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one, 3-ethyl-2-phenethylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one, 3-ethyl-2-(2-phenylethylthio)spiro[3,5,6-trihydrobenzo[h]quinazoline-5,1'-cycl opentane]-4-one
| Molecular Formula | C26H28N2OS |
|---|---|
| Molecular Weight | 416.19 g/mol |
| LogP | 5.6329 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 416.19223 |
| Heavy Atoms | 30 |
| Complexity | 1113.6227 |
Chemical Identifiers
| CAS Number | 337494-97-0 |
|---|---|
| SMILES | CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCCC5=CC=CC=C5 |
Product Overview
BAS 01322123 (CAS 337494-97-0), with molecular formula C26H28N2OS and molecular weight 416.19 g/mol. IUPAC: 3-ethyl-2-(2-phenylethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one.
Chemical Property Profile of BAS 01322123
Property Insights of BAS 01322123
The XLogP value of 5.6329 indicates that BAS 01322123 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, BAS 01322123 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01322123 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01322123?
The CAS number of BAS 01322123 is 337494-97-0.
What is the molecular formula of BAS 01322123?
The molecular formula of BAS 01322123 is C26H28N2OS.
What is the molecular weight of BAS 01322123?
The molecular weight of BAS 01322123 is 416.19 g/mol.
Where can I buy BAS 01322123?
You can request a quote for BAS 01322123 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01322123?
Yes, KEHONG BIO provides custom synthesis services for BAS 01322123 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.