甲氧甲基-3-苄基-2-吲哚基甲酮
TL;DR: 甲氧甲基-3-苄基-2-吲哚基甲酮 (CAS 101831-62-3) is a chemical compound with molecular formula C18H17NO2 and molecular weight 279.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲氧甲基-3-苄基-2-吲哚基甲酮
1-(3-benzyl-1H-indol-2-yl)-2-methoxyethanone
Also Known As: 1-Benzyl-2-(methoxyacetyl)indole, Methoxymethyl 3-benzyl-2-indolyl ketone, KETONE, METHOXYMETHYL 3-BENZYL-2-INDOLYL, 1-(3-benzyl-1H-indol-2-yl)-2-methoxyethan-1-one, Methoxymethyl(3-benzyl-1H-indol-2-yl) ketone
| Molecular Formula | C18H17NO2 |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.12592 |
| Heavy Atoms | 21 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 101831-62-3 |
|---|---|
| SMILES | COCC(=O)C1=C(C2=CC=CC=C2N1)CC3=CC=CC=C3 |
| InChIKey | AEGFGVNUWOUJCM-UHFFFAOYSA-N |
Product Overview
甲氧甲基-3-苄基-2-吲哚基甲酮 (CAS 101831-62-3), with molecular formula C18H17NO2 and molecular weight 279.13 g/mol. IUPAC: 1-(3-benzyl-1H-indol-2-yl)-2-methoxyethanone.
Chemical Property Profile of 甲氧甲基-3-苄基-2-吲哚基甲酮
Property Insights of 甲氧甲基-3-苄基-2-吲哚基甲酮
The XLogP value of 3.9 indicates that 甲氧甲基-3-苄基-2-吲哚基甲酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.1 Ų, 甲氧甲基-3-苄基-2-吲哚基甲酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲氧甲基-3-苄基-2-吲哚基甲酮 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 甲氧甲基-3-苄基-2-吲哚基甲酮?
The CAS number of 甲氧甲基-3-苄基-2-吲哚基甲酮 is 101831-62-3.
What is the molecular formula of 甲氧甲基-3-苄基-2-吲哚基甲酮?
The molecular formula of 甲氧甲基-3-苄基-2-吲哚基甲酮 is C18H17NO2.
What is the molecular weight of 甲氧甲基-3-苄基-2-吲哚基甲酮?
The molecular weight of 甲氧甲基-3-苄基-2-吲哚基甲酮 is 279.13 g/mol.
Where can I buy 甲氧甲基-3-苄基-2-吲哚基甲酮?
You can request a quote for 甲氧甲基-3-苄基-2-吲哚基甲酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲氧甲基-3-苄基-2-吲哚基甲酮?
Yes, KEHONG BIO provides custom synthesis services for 甲氧甲基-3-苄基-2-吲哚基甲酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.