8-Deoxyserratinidine
TL;DR: 8-Deoxyserratinidine (CAS 82841-99-4) is a chemical compound with molecular formula C18H28N2O and molecular weight 288.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methyl-13-azatetracyclo[7.7.0.01,6.02,13]hexadec-2-en-8-yl)acetamide
Also Known As: 8-Deoxyserratinidine, Fawcettidine, 5-(acetylamino)-5-deoxo-, (5alpha)-, Acetamide, N-(3,4,4a,5,6,6a,7,8-octahydro-8-methyl-1,9b-propano-2H-indeno(7,1-bc)azepin-5-yl)-, (1R-(1alpha,4aalpha,5alpha,6aalpha,8alpha,9balpha))-, Acetamide,N-(3,4,4a,5,6,6a,7,8-octahydro-8-methyl-1,9b-propano-2H-indeno(7,1-bc)azepin-5-yl)-,(1r-(1a,4aa,5a,6aa,8a,9ba))-, 6-Ethyl-7-hydroxy-4-(isobutylamino)-2,2-dimethyl-2,3-dihydro-5H-thiopyrano(2,3-b)pyridin-5-one
| Molecular Formula | C18H28N2O |
|---|---|
| Molecular Weight | 288.22 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.22015 |
| Heavy Atoms | 21 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 82841-99-4 |
|---|---|
| SMILES | CC1CC2CC(C3C24CCCN(C4=C1)CCC3)NC(=O)C |
| InChIKey | OUOOYDSFWFBZIG-UHFFFAOYSA-N |
Product Overview
8-Deoxyserratinidine (CAS 82841-99-4), with molecular formula C18H28N2O and molecular weight 288.22 g/mol. IUPAC: N-(4-methyl-13-azatetracyclo[7.7.0.01,6.02,13]hexadec-2-en-8-yl)acetamide.
Chemical Property Profile of 8-Deoxyserratinidine
Property Insights of 8-Deoxyserratinidine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Deoxyserratinidine. With a topological polar surface area (TPSA) of 32.3 Ų, 8-Deoxyserratinidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Deoxyserratinidine 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 8-Deoxyserratinidine?
The CAS number of 8-Deoxyserratinidine is 82841-99-4.
What is the molecular formula of 8-Deoxyserratinidine?
The molecular formula of 8-Deoxyserratinidine is C18H28N2O.
What is the molecular weight of 8-Deoxyserratinidine?
The molecular weight of 8-Deoxyserratinidine is 288.22 g/mol.
Where can I buy 8-Deoxyserratinidine?
You can request a quote for 8-Deoxyserratinidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Deoxyserratinidine?
Yes, KEHONG BIO provides custom synthesis services for 8-Deoxyserratinidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.