N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine
TL;DR: N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine (CAS 315672-99-2) is a chemical compound with molecular formula C15H18N2S and molecular weight 258.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-(thiophen-2-ylmethylideneamino)aniline
Also Known As: TimTec1_002617, N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine, N,N-diethyl-4-(thiophen-2-ylmethylideneamino)aniline, [4-((1E)-2-(2-thienyl)-1-azavinyl)phenyl]diethylamine, N,N-diethyl-N'-[(E)-thiophen-2-ylmethylidene]benzene-1,4-diamine
| Molecular Formula | C15H18N2S |
|---|---|
| Molecular Weight | 258.12 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.11908 |
| Heavy Atoms | 18 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 315672-99-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)N=CC2=CC=CS2 |
| InChIKey | ULIOLPSIMGSDQA-UHFFFAOYSA-N |
Product Overview
N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine (CAS 315672-99-2), with molecular formula C15H18N2S and molecular weight 258.12 g/mol. IUPAC: N,N-diethyl-4-(thiophen-2-ylmethylideneamino)aniline.
Chemical Property Profile of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine
Property Insights of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine
The XLogP value of 4.1 indicates that N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine has 0 hydrogen bond donor(s) and 3 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-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine?
The CAS number of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine is 315672-99-2.
What is the molecular formula of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine?
The molecular formula of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine is C15H18N2S.
What is the molecular weight of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine?
The molecular weight of N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine is 258.12 g/mol.
Where can I buy N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine?
You can request a quote for N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-N'-(2-thienylmethylene)-1,4-benzenediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.