BAS 01322191
TL;DR: BAS 01322191 (CAS 337496-06-7) is a chemical compound with molecular formula C32H36N2O3S and molecular weight 528.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-dimethyloxan-4-yl)-2-phenacylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: BAS 01322191, AN-512/12673363, 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 2-[(2-Oxo-2-phenylethyl)thio]-3-(tetrahydro-2,2-dimethyl-2H-pyran-4-yl)spiro[benzo[h]quinazoline-5(3H),1'-cyclohexan]-4(6H)-one, 3-(2,2-dimethyloxan-4-yl)-2-phenacylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
| Molecular Formula | C32H36N2O3S |
|---|---|
| Molecular Weight | 528.24 g/mol |
| LogP | 6.7734 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 528.2447 |
| Heavy Atoms | 38 |
| Complexity | 1405.9473 |
Chemical Identifiers
| CAS Number | 337496-06-7 |
|---|---|
| SMILES | CC1(CC(CCO1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)C6=CC=CC=C6)C |
Product Overview
BAS 01322191 (CAS 337496-06-7), with molecular formula C32H36N2O3S and molecular weight 528.24 g/mol. IUPAC: 3-(2,2-dimethyloxan-4-yl)-2-phenacylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of BAS 01322191
Property Insights of BAS 01322191
The XLogP value of 6.7734 indicates that BAS 01322191 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 01322191. Following Lipinski's Rule of Five, BAS 01322191 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01322191?
The CAS number of BAS 01322191 is 337496-06-7.
What is the molecular formula of BAS 01322191?
The molecular formula of BAS 01322191 is C32H36N2O3S.
What is the molecular weight of BAS 01322191?
The molecular weight of BAS 01322191 is 528.24 g/mol.
Where can I buy BAS 01322191?
You can request a quote for BAS 01322191 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01322191?
Yes, KEHONG BIO provides custom synthesis services for BAS 01322191 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.