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7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one
TL;DR: 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one (CAS 21603-77-0) is a chemical compound with molecular formula C7H12N2O and molecular weight 140.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7a-methyl-2,3,6,7-tetrahydro-1H-pyrrolo[1,2-a]imidazol-5-one
Also Known As: 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one, 7a-methylhexahydro-5H-pyrrolo[1,2-a]imidazol-5-one, BAS 10307763, 7a-methyltetrahydro-1H-pyrrolo[1,2-a]imidazol-5(6H)-one, 7a-methyl-hexahydro-1H-pyrrolo[1,2-a]imidazol-5-one
| Molecular Formula | C7H12N2O |
|---|---|
| Molecular Weight | 140.09 g/mol |
| LogP | -0.0718 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.09496 |
| Heavy Atoms | 10 |
| Complexity | 180.44492 |
Chemical Identifiers
| CAS Number | 21603-77-0 |
|---|---|
| SMILES | CC12CCC(=O)N1CCN2 |
Product Overview
7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one (CAS 21603-77-0), with molecular formula C7H12N2O and molecular weight 140.09 g/mol. IUPAC: 7a-methyl-2,3,6,7-tetrahydro-1H-pyrrolo[1,2-a]imidazol-5-one.
Chemical Property Profile of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one
Property Insights of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one
The XLogP value of -0.0718 indicates that 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.34 Ų, 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one has 1 hydrogen bond donor(s) and 2 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 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one?
The CAS number of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one is 21603-77-0.
What is the molecular formula of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one?
The molecular formula of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one is C7H12N2O.
What is the molecular weight of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one?
The molecular weight of 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one is 140.09 g/mol.
Where can I buy 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one?
You can request a quote for 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 7a-Methyl-hexahydro-pyrrolo[1,2-a]imidazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.