1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-
TL;DR: 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- (CAS 138272-98-7) 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.
(5-methoxy-2,3-dimethylindol-1-yl)-phenylmethanone
Also Known As: 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-, 1-benzoyl-5-methoxy-2,3-dimethyl-1H-indole, 1-Azabicyclo[2.2.2]octan-3-ol,3-(azidomethyl), (5-methoxy-2,3-dimethylindol-1-yl)-phenylmethanone, (5-Methoxy-2,3-dimethyl-1H-indol-1-yl)(phenyl)methanone
| Molecular Formula | C18H17NO2 |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.12592 |
| Heavy Atoms | 21 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 138272-98-7 |
|---|---|
| SMILES | CC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=CC=C3)C |
| InChIKey | ANCKMBHUDODKSF-UHFFFAOYSA-N |
Product Overview
1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- (CAS 138272-98-7), with molecular formula C18H17NO2 and molecular weight 279.13 g/mol. IUPAC: (5-methoxy-2,3-dimethylindol-1-yl)-phenylmethanone.
Chemical Property Profile of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-
Property Insights of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-
The XLogP value of 4.5 indicates that 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- has 0 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 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-?
The CAS number of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- is 138272-98-7.
What is the molecular formula of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-?
The molecular formula of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- is C18H17NO2.
What is the molecular weight of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-?
The molecular weight of 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- is 279.13 g/mol.
Where can I buy 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-?
You can request a quote for 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-indole, 1-benzoyl-5-methoxy-2,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.