7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one
TL;DR: 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one (CAS 200959-78-0) is a chemical compound with molecular formula C13H13N3O2S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-6-oxa-16-thia-2,12,14-triazatetracyclo[8.6.0.03,8.011,15]hexadeca-1(10),2,8,11(15)-tetraen-13-one
Also Known As: 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one, 7,7-dimethyl-3,6,7,9-tetrahydroimidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2(1H)-one
| Molecular Formula | C13H13N3O2S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 2.3172 |
| Topological Polar Surface Area | 70.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 275.07285 |
| Heavy Atoms | 19 |
| Complexity | 855.8895 |
Chemical Identifiers
| CAS Number | 200959-78-0 |
|---|---|
| SMILES | CC1(CC2=NC3=C(C=C2CO1)C4=C(S3)NC(=O)N4)C |
Product Overview
7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one (CAS 200959-78-0), with molecular formula C13H13N3O2S and molecular weight 275.07 g/mol. IUPAC: 5,5-dimethyl-6-oxa-16-thia-2,12,14-triazatetracyclo[8.6.0.03,8.011,15]hexadeca-1(10),2,8,11(15)-tetraen-13-one.
Chemical Property Profile of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one
Property Insights of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one
The XLogP value of 2.3172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one. The TPSA of 70.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one. Following Lipinski's Rule of Five, 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one has 2 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 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one?
The CAS number of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one is 200959-78-0.
What is the molecular formula of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one?
The molecular formula of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one is C13H13N3O2S.
What is the molecular weight of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one?
The molecular weight of 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one is 275.07 g/mol.
Where can I buy 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one?
You can request a quote for 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7,7-dimethyl-1,3,6,9-tetrahydro-2H,7H-imidazo[4',5':4,5]thieno[2,3-b]pyrano[3,4-e]pyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.