RefChem:335039
TL;DR: RefChem:335039 (CAS 50332-39-3) is a chemical compound with molecular formula C21H25NO3 and molecular weight 339.18344 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyclopentyl-1-(13,15-dioxa-9-azatetracyclo[8.7.0.02,8.012,16]heptadeca-1(17),2(8),10,12(16)-tetraen-3-yl)ethanone
Also Known As: 5-(Cyclopentylacetyl)-5,6,7,8,9,10-hexahydrocyclohepta(b)-1,3-dioxolo(4,5-f)indole, Cyclohepta(b)-1,3-dioxolo(4,5-f)indole, 5,6,7,8,9,10-hexahydro-5-(cyclopentylacetyl)-, 2-Cyclopentyl-1-(5,6,7,8,9,10-hexahydro-2H-cyclohepta[b][1,3]dioxolo[4,5-f]indol-10-yl)ethan-1-one, BRN 1025629
Technical Specifications
| Molecular Formula | C21H25NO3 |
| Molecular Weight | 339.18344 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.18344 Da |
| Heavy Atoms | 25 |
| Complexity | 503.0 |
| SMILES | C1CCC(C1)CC(=O)C2CCCCC3=C2C4=CC5=C(C=C4N3)OCO5 |
| InChIKey | QCQAYUUUWYDVPZ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:335039
Property Insights of RefChem:335039
The XLogP value of 5.0 indicates that RefChem:335039 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.3 Ų, RefChem:335039 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:335039 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:335039?
The CAS number of RefChem:335039 is 50332-39-3.
What is the molecular formula of RefChem:335039?
The molecular formula of RefChem:335039 is C21H25NO3.
What is the molecular weight of RefChem:335039?
The molecular weight of RefChem:335039 is 339.18344 g/mol.
Where can I buy RefChem:335039?
You can request a quote for RefChem:335039 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:335039?
Yes, CoreyChem provides custom synthesis services for RefChem:335039 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.