N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline
TL;DR: N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline (CAS 328068-71-9) is a chemical compound with molecular formula C27H23NOS and molecular weight 409.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methoxyphenyl)methyl]-4-(9H-thioxanthen-9-yl)aniline
Also Known As: N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline, N-[(4-methoxyphenyl)methyl]-4-(9H-thioxanthen-9-yl)aniline
| Molecular Formula | C27H23NOS |
|---|---|
| Molecular Weight | 409.15 g/mol |
| LogP | 6.9521 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.15002 |
| Heavy Atoms | 30 |
| Complexity | 1106.6078 |
Chemical Identifiers
| CAS Number | 328068-71-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC2=CC=C(C=C2)C3C4=CC=CC=C4SC5=CC=CC=C35 |
Product Overview
N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline (CAS 328068-71-9), with molecular formula C27H23NOS and molecular weight 409.15 g/mol. IUPAC: N-[(4-methoxyphenyl)methyl]-4-(9H-thioxanthen-9-yl)aniline.
Chemical Property Profile of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline
Property Insights of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline
The XLogP value of 6.9521 indicates that N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline?
The CAS number of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline is 328068-71-9.
What is the molecular formula of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline?
The molecular formula of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline is C27H23NOS.
What is the molecular weight of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline?
The molecular weight of N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline is 409.15 g/mol.
Where can I buy N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline?
You can request a quote for N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methoxybenzyl)-4-(9H-thioxanthen-9-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.