BAS 01322198
TL;DR: BAS 01322198 (CAS 337496-18-1) is a chemical compound with molecular formula C25H25N3O2S and molecular weight 431.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-methylphenyl)-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanylacetamide
Also Known As: BAS 01322198, AJ-292/12676494, 2-[3-(4-methylphenyl)-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanylacetamide, 2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide, 2-((4-oxo-3-(p-tolyl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetamide
| Molecular Formula | C25H25N3O2S |
|---|---|
| Molecular Weight | 431.17 g/mol |
| LogP | 4.15322 |
| Topological Polar Surface Area | 77.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.16675 |
| Heavy Atoms | 31 |
| Complexity | 1224.5048 |
Chemical Identifiers
| CAS Number | 337496-18-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC(=O)N |
Product Overview
BAS 01322198 (CAS 337496-18-1), with molecular formula C25H25N3O2S and molecular weight 431.17 g/mol. IUPAC: 2-[3-(4-methylphenyl)-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl]sulfanylacetamide.
Chemical Property Profile of BAS 01322198
Property Insights of BAS 01322198
The XLogP value of 4.15322 indicates that BAS 01322198 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01322198. Following Lipinski's Rule of Five, BAS 01322198 has 1 hydrogen bond donor(s) and 4 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 01322198?
The CAS number of BAS 01322198 is 337496-18-1.
What is the molecular formula of BAS 01322198?
The molecular formula of BAS 01322198 is C25H25N3O2S.
What is the molecular weight of BAS 01322198?
The molecular weight of BAS 01322198 is 431.17 g/mol.
Where can I buy BAS 01322198?
You can request a quote for BAS 01322198 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01322198?
Yes, KEHONG BIO provides custom synthesis services for BAS 01322198 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.