![2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one structure](/static/products/498/498537-07-8.png)
2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one
TL;DR: 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one (CAS 498537-07-8) is a chemical compound with molecular formula C21H24N2OS and molecular weight 352.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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: 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one, 2-methyl-10,11-dihydro-9H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(5H)-one
| Molecular Formula | C21H24N2OS |
|---|---|
| Molecular Weight | 352.16 g/mol |
| LogP | 4.47252 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 352.16095 |
| Heavy Atoms | 25 |
| Complexity | 908.8426 |
Chemical Identifiers
| CAS Number | 498537-07-8 |
|---|---|
| SMILES | CC1=CC2=C(CC3(CCCCC3)C4=C2N=C5N(C4=O)CCCS5)C=C1 |
Product Overview
2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one (CAS 498537-07-8), with molecular formula C21H24N2OS and molecular weight 352.16 g/mol. IUPAC: 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 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one
Property Insights of 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one
The XLogP value of 4.47252 indicates that 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one has 0 hydrogen bond donor(s) and 3 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 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one?
The CAS number of 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one is 498537-07-8.
What is the molecular formula of 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one?
The molecular formula of 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one is C21H24N2OS.
What is the molecular weight of 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one?
The molecular weight of 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one is 352.16 g/mol.
Where can I buy 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one?
You can request a quote for 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-10,11-dihydro-5H-spiro[benzo[h][1,3]thiazino[2,3-b]quinazoline-6,1'-cyclohexan]-7(9H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.