![1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one structure](/static/products/840/840477-64-7.png)
1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one
TL;DR: 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one (CAS 840477-64-7) is a chemical compound with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-hydroxyethyl)-5-methyl-15-thia-2,4,7-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-1(9),2,10(14)-trien-8-one
Also Known As: 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one
| Molecular Formula | C14H17N3O2S |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.10416 |
| Heavy Atoms | 20 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 840477-64-7 |
|---|---|
| SMILES | CC1CN2C(=O)C3=C(N=C2N1CCO)SC4=C3CCC4 |
| InChIKey | YWNYUYQHCSHYHJ-UHFFFAOYSA-N |
Product Overview
1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one (CAS 840477-64-7), with molecular formula C14H17N3O2S and molecular weight 291.10 g/mol. IUPAC: 4-(2-hydroxyethyl)-5-methyl-15-thia-2,4,7-triazatetracyclo[7.6.0.03,7.010,14]pentadeca-1(9),2,10(14)-trien-8-one.
Chemical Property Profile of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one
Property Insights of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one. Following Lipinski's Rule of Five, 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one 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 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one?
The CAS number of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one is 840477-64-7.
What is the molecular formula of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one?
The molecular formula of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one is C14H17N3O2S.
What is the molecular weight of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one?
The molecular weight of 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one is 291.10 g/mol.
Where can I buy 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one?
You can request a quote for 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-hydroxyethyl)-2-methyl-2,3,7,8-tetrahydro-1H-cyclopenta[4,5]thieno[2,3-d]imidazo[1,2-a]pyrimidin-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.