BAS 01322239
TL;DR: BAS 01322239 (CAS 337496-69-2) is a chemical compound with molecular formula C25H30N2OS and molecular weight 406.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclopentylmethyl)-2-prop-2-enylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: BAS 01322239, AJ-292/11752005, 2-(allylsulfanyl)-3-(cyclopentylmethyl)-5,6-dihydrospiro(benzo[h]quinazoline-5,1'-cyclopentane)-4(3H)-one, 3-(cyclopentylmethyl)-2-prop-2-enylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one, 2-(allylthio)-3-(cyclopentylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
| Molecular Formula | C25H30N2OS |
|---|---|
| Molecular Weight | 406.21 g/mol |
| LogP | 5.7465 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.2079 |
| Heavy Atoms | 29 |
| Complexity | 980.8033 |
Chemical Identifiers
| CAS Number | 337496-69-2 |
|---|---|
| SMILES | C=CCSC1=NC2=C(C(=O)N1CC3CCCC3)C4(CCCC4)CC5=CC=CC=C52 |
Product Overview
BAS 01322239 (CAS 337496-69-2), with molecular formula C25H30N2OS and molecular weight 406.21 g/mol. IUPAC: 3-(cyclopentylmethyl)-2-prop-2-enylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one.
Chemical Property Profile of BAS 01322239
Property Insights of BAS 01322239
The XLogP value of 5.7465 indicates that BAS 01322239 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 01322239 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01322239 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 01322239?
The CAS number of BAS 01322239 is 337496-69-2.
What is the molecular formula of BAS 01322239?
The molecular formula of BAS 01322239 is C25H30N2OS.
What is the molecular weight of BAS 01322239?
The molecular weight of BAS 01322239 is 406.21 g/mol.
Where can I buy BAS 01322239?
You can request a quote for BAS 01322239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01322239?
Yes, KEHONG BIO provides custom synthesis services for BAS 01322239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.