A3416/0144908
TL;DR: A3416/0144908 (CAS 489401-25-4) is a chemical compound with molecular formula C26H28N2O2S and molecular weight 432.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-methoxyphenyl)-2-propan-2-ylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: A3416/0144908, 2-(isopropylthio)-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one, 3-(3-methoxyphenyl)-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one, 3-(3-METHOXYPHENYL)-2-(PROPAN-2-YLSULFANYL)-4,6-DIHYDRO-3H-SPIRO[BENZO[H]QUINAZOLINE-5,1'-CYCLOPENTAN]-4-ONE, 3-(3-methoxyphenyl)-2-propan-2-ylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
| Molecular Formula | C26H28N2O2S |
|---|---|
| Molecular Weight | 432.19 g/mol |
| LogP | 5.7765 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.18716 |
| Heavy Atoms | 31 |
| Complexity | 1192.2516 |
Chemical Identifiers
| CAS Number | 489401-25-4 |
|---|---|
| SMILES | CC(C)SC1=NC2=C(C(=O)N1C3=CC(=CC=C3)OC)C4(CCCC4)CC5=CC=CC=C52 |
Product Overview
A3416/0144908 (CAS 489401-25-4), with molecular formula C26H28N2O2S and molecular weight 432.19 g/mol. IUPAC: 3-(3-methoxyphenyl)-2-propan-2-ylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one.
Chemical Property Profile of A3416/0144908
Property Insights of A3416/0144908
The XLogP value of 5.7765 indicates that A3416/0144908 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, A3416/0144908 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3416/0144908 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 A3416/0144908?
The CAS number of A3416/0144908 is 489401-25-4.
What is the molecular formula of A3416/0144908?
The molecular formula of A3416/0144908 is C26H28N2O2S.
What is the molecular weight of A3416/0144908?
The molecular weight of A3416/0144908 is 432.19 g/mol.
Where can I buy A3416/0144908?
You can request a quote for A3416/0144908 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3416/0144908?
Yes, KEHONG BIO provides custom synthesis services for A3416/0144908 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.