Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide
TL;DR: Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide (CAS 125219-84-3) is a chemical compound with molecular formula C13H12O4S and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3,3-dioxo-1,2,5,9b-tetrahydrobenzo[e][1]benzothiole-6,9-dione
Also Known As: 4-Methyl-3,3,6,9-tetraoxo-1,2,5,6,9,9b-hexahydrothieno(3,2-a)naphthalene, 1,2,5,9b-Tetrahydro-4-methylnaphtho(2,1-b)thiophene-6,9-dione 3,3-dioxide, Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide, 4-methyl-3,3-dioxo-1,2,5,9b-tetrahydrobenzo[e][1]benzothiole-6,9-dione, 4-Methyl-5,9b-dihydro-1H-3lambda~6~-naphtho[2,1-b]thiophene-3,3,6,9(2H)-tetrone
| Molecular Formula | C13H12O4S |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | 1.1034 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.04562 |
| Heavy Atoms | 18 |
| Complexity | 673.7798 |
Chemical Identifiers
| CAS Number | 125219-84-3 |
|---|---|
| SMILES | CC1=C2C(CCS2(=O)=O)C3=C(C1)C(=O)C=CC3=O |
Product Overview
Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide (CAS 125219-84-3), with molecular formula C13H12O4S and molecular weight 264.05 g/mol. IUPAC: 4-methyl-3,3-dioxo-1,2,5,9b-tetrahydrobenzo[e][1]benzothiole-6,9-dione.
Chemical Property Profile of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide
Property Insights of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide
The XLogP value of 1.1034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide. Following Lipinski's Rule of Five, Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide has 0 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 Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide?
The CAS number of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide is 125219-84-3.
What is the molecular formula of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide?
The molecular formula of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide is C13H12O4S.
What is the molecular weight of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide?
The molecular weight of Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide is 264.05 g/mol.
Where can I buy Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide?
You can request a quote for Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Naphtho(2,1-b)thiophene-6,9-dione, 1,2,5,9b-tetrahydro-4-methyl-, 3,3-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.