1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-
TL;DR: 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- (CAS 89969-77-7) is a chemical compound with molecular formula C13H16N2O and molecular weight 216.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-(1,2-dimethylindol-3-yl)propylidene]hydroxylamine
Also Known As: 2-amylbenzothiophene, 1,2-di-methyl-3-propionylindole oxime, 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-, N-[1-(1,2-dimethylindol-3-yl)propylidene]hydroxylamine, N-[1-(1,2-Dimethyl-1H-indol-3-yl)propylidene]hydroxylamine
| Molecular Formula | C13H16N2O |
|---|---|
| Molecular Weight | 216.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.12627 |
| Heavy Atoms | 16 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 89969-77-7 |
|---|---|
| SMILES | CCC(=NO)C1=C(N(C2=CC=CC=C21)C)C |
| InChIKey | RMEWJAZWSZUDIS-UHFFFAOYSA-N |
Product Overview
1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- (CAS 89969-77-7), with molecular formula C13H16N2O and molecular weight 216.13 g/mol. IUPAC: N-[1-(1,2-dimethylindol-3-yl)propylidene]hydroxylamine.
Chemical Property Profile of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-
Property Insights of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-. With a topological polar surface area (TPSA) of 37.5 Ų, 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- 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 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-?
The CAS number of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- is 89969-77-7.
What is the molecular formula of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-?
The molecular formula of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- is C13H16N2O.
What is the molecular weight of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-?
The molecular weight of 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- is 216.13 g/mol.
Where can I buy 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-?
You can request a quote for 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 1-(1,2-dimethyl-1H-indol-3-yl)-, oxime, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.