A3423/0145224
TL;DR: A3423/0145224 (CAS 586992-81-6) is a chemical compound with molecular formula C29H30F3N3O2S and molecular weight 541.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxo-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: A3423/0145224, 2-(4-oxo-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide, 2-((4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide, 2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide, 2-[(4-OXO-3-PROPYL-4,6-DIHYDRO-3H-SPIRO[BENZO[H]QUINAZOLINE-5,1'-CYCLOHEXAN]-2-YL)THIO]-N-[3-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
| Molecular Formula | C29H30F3N3O2S |
|---|---|
| Molecular Weight | 541.20 g/mol |
| LogP | 6.8279 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 541.2011 |
| Heavy Atoms | 38 |
| Complexity | 1410.9077 |
Chemical Identifiers
| CAS Number | 586992-81-6 |
|---|---|
| SMILES | CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC(=C5)C(F)(F)F |
Product Overview
A3423/0145224 (CAS 586992-81-6), with molecular formula C29H30F3N3O2S and molecular weight 541.20 g/mol. IUPAC: 2-(4-oxo-3-propylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of A3423/0145224
Property Insights of A3423/0145224
The XLogP value of 6.8279 indicates that A3423/0145224 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for A3423/0145224. Following Lipinski's Rule of Five, A3423/0145224 has 1 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 A3423/0145224?
The CAS number of A3423/0145224 is 586992-81-6.
What is the molecular formula of A3423/0145224?
The molecular formula of A3423/0145224 is C29H30F3N3O2S.
What is the molecular weight of A3423/0145224?
The molecular weight of A3423/0145224 is 541.20 g/mol.
Where can I buy A3423/0145224?
You can request a quote for A3423/0145224 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3423/0145224?
Yes, KEHONG BIO provides custom synthesis services for A3423/0145224 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.