ChemDiv3_005986
TL;DR: ChemDiv3_005986 (CAS 438529-28-3) is a chemical compound with molecular formula C25H25NO2 and molecular weight 371.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3,4-dimethylphenoxy)methyl]phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
Also Known As: ChemDiv3_005986, IDI1_023896, 1-{4-[(3,4-dimethylphenoxy)methyl]benzoyl}-2-methylindoline, [4-[(3,4-dimethylphenoxy)methyl]phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone, {4-[(3,4-dimethylphenoxy)methyl]phenyl}(2-methyl-2,3-dihydro-1H-indol-1-yl)methanone
| Molecular Formula | C25H25NO2 |
|---|---|
| Molecular Weight | 371.19 g/mol |
| LogP | 5.47384 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.18854 |
| Heavy Atoms | 28 |
| Complexity | 1007.31134 |
Chemical Identifiers
| CAS Number | 438529-28-3 |
|---|---|
| SMILES | CC1CC2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)COC4=CC(=C(C=C4)C)C |
Product Overview
ChemDiv3_005986 (CAS 438529-28-3), with molecular formula C25H25NO2 and molecular weight 371.19 g/mol. IUPAC: [4-[(3,4-dimethylphenoxy)methyl]phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone.
Chemical Property Profile of ChemDiv3_005986
Property Insights of ChemDiv3_005986
The XLogP value of 5.47384 indicates that ChemDiv3_005986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, ChemDiv3_005986 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_005986 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_005986?
The CAS number of ChemDiv3_005986 is 438529-28-3.
What is the molecular formula of ChemDiv3_005986?
The molecular formula of ChemDiv3_005986 is C25H25NO2.
What is the molecular weight of ChemDiv3_005986?
The molecular weight of ChemDiv3_005986 is 371.19 g/mol.
Where can I buy ChemDiv3_005986?
You can request a quote for ChemDiv3_005986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005986?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.