7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione
TL;DR: 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione (CAS 70059-68-6) is a chemical compound with molecular formula C11H10N4S2 and molecular weight 262.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione
Also Known As: BAS 00565262, 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione, 8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3(2H)-thione, 10-thia-3,4,6,8-tetraazatetracyclo[7.7.0.0^{2,6}.0^{11,16}]hexadeca-1(9),2,4,7,11(16)-pentaene-5-thiol
| Molecular Formula | C11H10N4S2 |
|---|---|
| Molecular Weight | 262.03 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.0347 |
| Heavy Atoms | 17 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 70059-68-6 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN4C3=NNC4=S |
| InChIKey | LFPWPIGOSDJCPJ-UHFFFAOYSA-N |
Product Overview
7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione (CAS 70059-68-6), with molecular formula C11H10N4S2 and molecular weight 262.03 g/mol. IUPAC: 10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,7,11(16)-tetraene-5-thione.
Chemical Property Profile of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione
Property Insights of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione. Following Lipinski's Rule of Five, 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione 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 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione?
The CAS number of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione is 70059-68-6.
What is the molecular formula of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione?
The molecular formula of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione is C11H10N4S2.
What is the molecular weight of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione?
The molecular weight of 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione is 262.03 g/mol.
Where can I buy 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione?
You can request a quote for 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 7,8,9,10-Tetrahydro-2H-6-thia-1,2,3a,5-tetraaza-cyclopenta[c]fluorene-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.