A3616/0153304
TL;DR: A3616/0153304 (CAS 497942-82-2) is a chemical compound with molecular formula C21H24N2O2S and molecular weight 368.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-hydroxy-4-methylspiro[16-thia-12,18-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),3,5,17-pentaene-9,1'-cyclohexane]-11-one
Also Known As: A3616/0153304, 10-hydroxy-2-methyl-10,11-dihydro-9H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(5H)-one, 10-hydroxy-2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one
| Molecular Formula | C21H24N2O2S |
|---|---|
| Molecular Weight | 368.16 g/mol |
| LogP | 3.44332 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 368.15585 |
| Heavy Atoms | 26 |
| Complexity | 943.75775 |
Chemical Identifiers
| CAS Number | 497942-82-2 |
|---|---|
| SMILES | CC1=CC2=C(CC3(CCCCC3)C4=C2N=C5N(C4=O)CC(CS5)O)C=C1 |
Product Overview
A3616/0153304 (CAS 497942-82-2), with molecular formula C21H24N2O2S and molecular weight 368.16 g/mol. IUPAC: 14-hydroxy-4-methylspiro[16-thia-12,18-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),3,5,17-pentaene-9,1'-cyclohexane]-11-one.
Chemical Property Profile of A3616/0153304
Property Insights of A3616/0153304
The XLogP value of 3.44332 indicates that A3616/0153304 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.12 Ų, A3616/0153304 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3616/0153304 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 A3616/0153304?
The CAS number of A3616/0153304 is 497942-82-2.
What is the molecular formula of A3616/0153304?
The molecular formula of A3616/0153304 is C21H24N2O2S.
What is the molecular weight of A3616/0153304?
The molecular weight of A3616/0153304 is 368.16 g/mol.
Where can I buy A3616/0153304?
You can request a quote for A3616/0153304 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3616/0153304?
Yes, KEHONG BIO provides custom synthesis services for A3616/0153304 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.