n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline
TL;DR: n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline (CAS 124534-05-0) is a chemical compound with molecular formula C11H15NS3 and molecular weight 257.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-4-(1,3,5-trithian-2-yl)aniline
Also Known As: n,n-dimethyl-4-(1,3,5-trithian-2-yl)aniline, (8aS)-8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione
| Molecular Formula | C11H15NS3 |
|---|---|
| Molecular Weight | 257.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.03665 |
| Heavy Atoms | 15 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 124534-05-0 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2SCSCS2 |
| InChIKey | HQSYRKBYADVREP-UHFFFAOYSA-N |
Product Overview
n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline (CAS 124534-05-0), with molecular formula C11H15NS3 and molecular weight 257.04 g/mol. IUPAC: N,N-dimethyl-4-(1,3,5-trithian-2-yl)aniline.
Chemical Property Profile of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline
Property Insights of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline
The XLogP value of 3.9 indicates that n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline. Following Lipinski's Rule of Five, n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline has 0 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,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline?
The CAS number of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline is 124534-05-0.
What is the molecular formula of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline?
The molecular formula of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline is C11H15NS3.
What is the molecular weight of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline?
The molecular weight of n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline is 257.04 g/mol.
Where can I buy n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline?
You can request a quote for n,n-Dimethyl-4-(1,3,5-trithian-2-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,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for n,n-Dimethyl-4-(1,3,5-trithian-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.