ChemDiv2_001334
TL;DR: ChemDiv2_001334 (CAS 526188-72-7) is a chemical compound with molecular formula C23H21N3O2 and molecular weight 371.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methylpyridin-2-amine
Also Known As: ChemDiv2_001334, N-[(2H-1,3-benzodioxol-5-yl)(2-methyl-1H-indol-3-yl)methyl]-4-methylpyridin-2-amine, AF-399/41378328, F1217-0122, N-[1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methylpyridin-2-amine
| Molecular Formula | C23H21N3O2 |
|---|---|
| Molecular Weight | 371.16 g/mol |
| LogP | 5.10994 |
| Topological Polar Surface Area | 59.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.1634 |
| Heavy Atoms | 28 |
| Complexity | 1165.6963 |
Chemical Identifiers
| CAS Number | 526188-72-7 |
|---|---|
| SMILES | CC1=CC(=NC=C1)NC(C2=CC3=C(C=C2)OCO3)C4=C(NC5=CC=CC=C54)C |
Product Overview
ChemDiv2_001334 (CAS 526188-72-7), with molecular formula C23H21N3O2 and molecular weight 371.16 g/mol. IUPAC: N-[1,3-benzodioxol-5-yl-(2-methyl-1H-indol-3-yl)methyl]-4-methylpyridin-2-amine.
Chemical Property Profile of ChemDiv2_001334
Property Insights of ChemDiv2_001334
The XLogP value of 5.10994 indicates that ChemDiv2_001334 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.17 Ų, ChemDiv2_001334 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_001334 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv2_001334?
The CAS number of ChemDiv2_001334 is 526188-72-7.
What is the molecular formula of ChemDiv2_001334?
The molecular formula of ChemDiv2_001334 is C23H21N3O2.
What is the molecular weight of ChemDiv2_001334?
The molecular weight of ChemDiv2_001334 is 371.16 g/mol.
Where can I buy ChemDiv2_001334?
You can request a quote for ChemDiv2_001334 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_001334?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_001334 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.