N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline
TL;DR: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline (CAS 355816-58-9) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline
Also Known As: BAS 01125330, N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline, (3,5-Dimethyl-phenyl)-(7-methoxy-benzo[1,3]dioxol-5-ylmethyl)-amine, N-[(7-METHOXY-2H-1,3-BENZODIOXOL-5-YL)METHYL]-3,5-DIMETHYLANILINE, N-(3,5-DIMETHYLPHENYL)-N-[(7-METHOXY-1,3-BENZODIOXOL-5-YL)METHYL]AMINE
| Molecular Formula | C17H19NO3 |
|---|---|
| Molecular Weight | 285.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 39.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.1365 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 355816-58-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NCC2=CC3=C(C(=C2)OC)OCO3)C |
| InChIKey | JHERRAOXMKBNKY-UHFFFAOYSA-N |
Product Overview
N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline (CAS 355816-58-9), with molecular formula C17H19NO3 and molecular weight 285.14 g/mol. IUPAC: N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline.
Chemical Property Profile of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline
Property Insights of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline
The XLogP value of 3.9 indicates that N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.7 Ų, N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline has 1 hydrogen bond donor(s) and 4 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 N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline?
The CAS number of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline is 355816-58-9.
What is the molecular formula of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline?
The molecular formula of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline is C17H19NO3.
What is the molecular weight of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline?
The molecular weight of N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline is 285.14 g/mol.
Where can I buy N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline?
You can request a quote for N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-3,5-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.