(7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one
TL;DR: (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one (CAS 224157-99-7) is a chemical compound with molecular formula C17H25N5O and molecular weight 315.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(11R,15S)-4-hexyl-8-methyl-1,3,5,8,10-pentazatetracyclo[7.6.0.02,6.011,15]pentadeca-2(6),3,9-trien-7-one
Also Known As: (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one, 2-hexyl-5-methyl-(6aR,9aS)-3,4,5,8-tetrahydrocyclopenta[4,5]imidazo[2,1-b]purin-4-one, 2-Hexyl-5-methyl-7,8-propano-1,4,7beta,8beta-tetrahydro-5H-imidazo[2,1-b]purine-4-one, (11R,15S)-4-hexyl-8-methyl-1,3,5,8,10-pentaazatetracyclo[7.6.0.02,6.011,15]pentadeca-2(6),3,9-trien-7-one, (11R,15S)-4-hexyl-8-methyl-1,3,5,8,10-pentazatetracyclo[7.6.0.02,6.011,15]pentadeca-2(6),3,9-trien-7-one
| Molecular Formula | C17H25N5O |
|---|---|
| Molecular Weight | 315.21 g/mol |
| LogP | 2.7152 |
| Topological Polar Surface Area | 64.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.2059 |
| Heavy Atoms | 23 |
| Complexity | 649.40894 |
Chemical Identifiers
| CAS Number | 224157-99-7 |
|---|---|
| SMILES | CCCCCCC1=NC2=C(N1)C(=O)N(C3=N[C@@H]4CCC[C@@H]4N23)C |
Product Overview
(7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one (CAS 224157-99-7), with molecular formula C17H25N5O and molecular weight 315.21 g/mol. IUPAC: (11R,15S)-4-hexyl-8-methyl-1,3,5,8,10-pentazatetracyclo[7.6.0.02,6.011,15]pentadeca-2(6),3,9-trien-7-one.
Chemical Property Profile of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one
Property Insights of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one
The XLogP value of 2.7152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one. The TPSA of 64.59 Ų falls within the moderate polarity range, balancing permeability and solubility for (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one. Following Lipinski's Rule of Five, (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-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 (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one?
The CAS number of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one is 224157-99-7.
What is the molecular formula of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one?
The molecular formula of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one is C17H25N5O.
What is the molecular weight of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one?
The molecular weight of (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one is 315.21 g/mol.
Where can I buy (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one?
You can request a quote for (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for (7R,8S)-2-Hexyl-5-methyl-7,8-propano-7,8-dihydro-3H-imidazo[2,1-b]purin-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.