![12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione structure](/static/products/370/370840-96-3.png)
12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione
TL;DR: 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione (CAS 370840-96-3) is a chemical compound with molecular formula C13H12N6OS3 and molecular weight 364.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15,15-dimethyl-16-oxa-19-thia-2,4,5,7,9,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione
Also Known As: 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione, 12,12-dimethyl-3-sulfanyl-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-7(6H)-thione
| Molecular Formula | C13H12N6OS3 |
|---|---|
| Molecular Weight | 364.02 g/mol |
| LogP | 3.16318 |
| Topological Polar Surface Area | 75.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 364.02347 |
| Heavy Atoms | 23 |
| Complexity | 1219.965 |
Chemical Identifiers
| CAS Number | 370840-96-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C4=NNC(=S)N4C5=NNC(=S)N35)C |
Product Overview
12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione (CAS 370840-96-3), with molecular formula C13H12N6OS3 and molecular weight 364.02 g/mol. IUPAC: 15,15-dimethyl-16-oxa-19-thia-2,4,5,7,9,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),5,10,13(18)-tetraene-3,8-dithione.
Chemical Property Profile of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione
Property Insights of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione
The XLogP value of 3.16318 indicates that 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione. Following Lipinski's Rule of Five, 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione has 2 hydrogen bond donor(s) and 6 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 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione?
The CAS number of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione is 370840-96-3.
What is the molecular formula of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione?
The molecular formula of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione is C13H12N6OS3.
What is the molecular weight of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione?
The molecular weight of 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione is 364.02 g/mol.
Where can I buy 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione?
You can request a quote for 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione?
Yes, KEHONG BIO provides custom synthesis services for 12,12-dimethyl-12,13-dihydro-2H-pyrano[4',3':4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7(6H,10H)-dithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.