ChemDiv1_024621
TL;DR: ChemDiv1_024621 (CAS 374092-64-5) is a chemical compound with molecular formula C24H22N4O2S and molecular weight 430.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(4-methoxyphenyl)-16-sulfanylidenespiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13-pentaene-9,1'-cyclopentane]-11-one
Also Known As: ChemDiv1_024621, 1-mercapto-4-(4-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one, 4-(4-methoxyphenyl)-1-sulfanyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
| Molecular Formula | C24H22N4O2S |
|---|---|
| Molecular Weight | 430.15 g/mol |
| LogP | 4.58629 |
| Topological Polar Surface Area | 64.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 430.14636 |
| Heavy Atoms | 31 |
| Complexity | 1439.4537 |
Chemical Identifiers
| CAS Number | 374092-64-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N6C2=NNC6=S |
Product Overview
ChemDiv1_024621 (CAS 374092-64-5), with molecular formula C24H22N4O2S and molecular weight 430.15 g/mol. IUPAC: 12-(4-methoxyphenyl)-16-sulfanylidenespiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13-pentaene-9,1'-cyclopentane]-11-one.
Chemical Property Profile of ChemDiv1_024621
Property Insights of ChemDiv1_024621
The XLogP value of 4.58629 indicates that ChemDiv1_024621 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.32 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_024621. Following Lipinski's Rule of Five, ChemDiv1_024621 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_024621?
The CAS number of ChemDiv1_024621 is 374092-64-5.
What is the molecular formula of ChemDiv1_024621?
The molecular formula of ChemDiv1_024621 is C24H22N4O2S.
What is the molecular weight of ChemDiv1_024621?
The molecular weight of ChemDiv1_024621 is 430.15 g/mol.
Where can I buy ChemDiv1_024621?
You can request a quote for ChemDiv1_024621 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024621?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024621 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.