BAS 01322157
TL;DR: BAS 01322157 (CAS 337495-54-2) is a chemical compound with molecular formula C29H32N2O4S and molecular weight 504.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[(4-methoxyphenyl)methyl]-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanylacetate
Also Known As: BAS 01322157, AN-512/12673321, ethyl 2-[3-[(4-methoxyphenyl)methyl]-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanylacetate, ethyl {[3-(4-methoxybenzyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetate, ethyl {[3-(4-methoxybenzyl)-4-oxo-3,4,5,6-tetrahydrospiro(benzo[h]quinazoline-5,1'-cyclohexane)-2-yl]sulfanyl}acetate
| Molecular Formula | C29H32N2O4S |
|---|---|
| Molecular Weight | 504.21 g/mol |
| LogP | 5.3804 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.20828 |
| Heavy Atoms | 36 |
| Complexity | 1309.8397 |
Chemical Identifiers
| CAS Number | 337495-54-2 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)OC)C4(CCCCC4)CC5=CC=CC=C52 |
Product Overview
BAS 01322157 (CAS 337495-54-2), with molecular formula C29H32N2O4S and molecular weight 504.21 g/mol. IUPAC: ethyl 2-[3-[(4-methoxyphenyl)methyl]-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanylacetate.
Chemical Property Profile of BAS 01322157
Property Insights of BAS 01322157
The XLogP value of 5.3804 indicates that BAS 01322157 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01322157. Following Lipinski's Rule of Five, BAS 01322157 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01322157?
The CAS number of BAS 01322157 is 337495-54-2.
What is the molecular formula of BAS 01322157?
The molecular formula of BAS 01322157 is C29H32N2O4S.
What is the molecular weight of BAS 01322157?
The molecular weight of BAS 01322157 is 504.21 g/mol.
Where can I buy BAS 01322157?
You can request a quote for BAS 01322157 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01322157?
Yes, KEHONG BIO provides custom synthesis services for BAS 01322157 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.