Tetrahydrofugapavine-oxim
TL;DR: Tetrahydrofugapavine-oxim (CAS 301353-35-5) is a chemical compound with molecular formula C18H22N2O3 and molecular weight 314.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(11-methylspiro[3,5-dioxa-11-azatetracyclo[6.6.1.02,6.012,15]pentadeca-1(15),2(6),7-triene-14,4'-cyclohexane]-1'-ylidene)hydroxylamine
Also Known As: Tetrahydrofugapavine-oxim, BAS 00334915, AJ-292/21168112, N-hydroxy-3'-methyl-2a',3',4',5'-tetrahydro-2'H,4H-spiro[cyclohexane-1,1'-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-imine, (7R,Z)-8H-3'-methyl-2a',3',4',5'-tetrahydro-2'H-spiro[cyclohexane-1,1'-cyclopenta[ij][1,3]dioxolo[4,5-g]isoquinolin]-4-one oxime
| Molecular Formula | C18H22N2O3 |
|---|---|
| Molecular Weight | 314.16 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 54.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.16306 |
| Heavy Atoms | 23 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 301353-35-5 |
|---|---|
| SMILES | CN1CCC2=CC3=C(C4=C2C1CC45CCC(=NO)CC5)OCO3 |
| InChIKey | QSAYUFLRSCGDQM-UHFFFAOYSA-N |
Product Overview
Tetrahydrofugapavine-oxim (CAS 301353-35-5), with molecular formula C18H22N2O3 and molecular weight 314.16 g/mol. IUPAC: N-(11-methylspiro[3,5-dioxa-11-azatetracyclo[6.6.1.02,6.012,15]pentadeca-1(15),2(6),7-triene-14,4'-cyclohexane]-1'-ylidene)hydroxylamine.
Chemical Property Profile of Tetrahydrofugapavine-oxim
Property Insights of Tetrahydrofugapavine-oxim
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tetrahydrofugapavine-oxim. With a topological polar surface area (TPSA) of 54.3 Ų, Tetrahydrofugapavine-oxim exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydrofugapavine-oxim has 1 hydrogen bond donor(s) and 5 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 Tetrahydrofugapavine-oxim?
The CAS number of Tetrahydrofugapavine-oxim is 301353-35-5.
What is the molecular formula of Tetrahydrofugapavine-oxim?
The molecular formula of Tetrahydrofugapavine-oxim is C18H22N2O3.
What is the molecular weight of Tetrahydrofugapavine-oxim?
The molecular weight of Tetrahydrofugapavine-oxim is 314.16 g/mol.
Where can I buy Tetrahydrofugapavine-oxim?
You can request a quote for Tetrahydrofugapavine-oxim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydrofugapavine-oxim?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydrofugapavine-oxim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.