1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-
TL;DR: 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- (CAS 58322-97-7) is a chemical compound with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,4,4a-tetrahydrodibenzofuran-4-yl]-2-pyrrolidin-1-ylacetamide
Also Known As: 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-, N-(8,9b-Dimethyl-3-oxo-1,2,3,4,4a,9b-hexahydrodibenzo[b,d]furan-4-yl)-2-(pyrrolidin-1-yl)ethanimidic acid, N-[(4S,4aS,9bR)-8,9b-Dimethyl-3-oxo-1,2,3,4,4a,9b-hexahydrodibenzo[b,d]furan-4-yl](pyrrolidin-1-yl)ethanimidic acid, N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,4,4a-tetrahydrodibenzofuran-4-yl]-2-pyrrolidin-1-ylacetamide, RefChem:235159
| Molecular Formula | C20H26N2O3 |
|---|---|
| Molecular Weight | 342.19 g/mol |
| LogP | 1.95722 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.19434 |
| Heavy Atoms | 25 |
| Complexity | 710.8929 |
Chemical Identifiers
| CAS Number | 58322-97-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)O[C@H]3[C@@]2(CCC(=O)[C@H]3NC(=O)CN4CCCC4)C |
Product Overview
1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- (CAS 58322-97-7), with molecular formula C20H26N2O3 and molecular weight 342.19 g/mol. IUPAC: N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,4,4a-tetrahydrodibenzofuran-4-yl]-2-pyrrolidin-1-ylacetamide.
Chemical Property Profile of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-
Property Insights of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-
The XLogP value of 1.95722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-. With a topological polar surface area (TPSA) of 58.64 Ų, 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- 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-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-?
The CAS number of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- is 58322-97-7.
What is the molecular formula of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-?
The molecular formula of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- is C20H26N2O3.
What is the molecular weight of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-?
The molecular weight of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- is 342.19 g/mol.
Where can I buy 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-?
You can request a quote for 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.