BAS 01322159
TL;DR: BAS 01322159 (CAS 337495-58-6) is a chemical compound with molecular formula C33H34N2O2S and molecular weight 522.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methoxyphenyl)methyl]-2-(2-phenylethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: BAS 01322159, AN-512/12673298, 3-[(4-methoxyphenyl)methyl]-2-(2-phenylethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one, 3-(4-methoxybenzyl)-2-[(2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 3-(4-methoxybenzyl)-2-[(2-phenylethyl)sulfanyl]-5,6-dihydrospiro(benzo[h]quinazoline-5,1'-cyclohexane)-4(3H)-one
| Molecular Formula | C33H34N2O2S |
|---|---|
| Molecular Weight | 522.23 g/mol |
| LogP | 7.06 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 522.2341 |
| Heavy Atoms | 38 |
| Complexity | 1471.6108 |
Chemical Identifiers
| CAS Number | 337495-58-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCCC6=CC=CC=C6 |
Product Overview
BAS 01322159 (CAS 337495-58-6), with molecular formula C33H34N2O2S and molecular weight 522.23 g/mol. IUPAC: 3-[(4-methoxyphenyl)methyl]-2-(2-phenylethylsulfanyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of BAS 01322159
Property Insights of BAS 01322159
The XLogP value of 7.06 indicates that BAS 01322159 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, BAS 01322159 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01322159 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01322159?
The CAS number of BAS 01322159 is 337495-58-6.
What is the molecular formula of BAS 01322159?
The molecular formula of BAS 01322159 is C33H34N2O2S.
What is the molecular weight of BAS 01322159?
The molecular weight of BAS 01322159 is 522.23 g/mol.
Where can I buy BAS 01322159?
You can request a quote for BAS 01322159 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01322159?
Yes, KEHONG BIO provides custom synthesis services for BAS 01322159 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.