N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine
TL;DR: N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine (CAS 892592-91-5) is a chemical compound with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(4-nitrophenyl)-N-(thiophen-3-ylmethyl)ethane-1,2-diamine
Also Known As: N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine, N'-(4-nitrophenyl)-N-(thiophen-3-ylmethyl)ethane-1,2-diamine, 4-NITRO-N-{2-[(THIOPHEN-3-YLMETHYL)AMINO]ETHYL}ANILINE
| Molecular Formula | C13H15N3O2S |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 2.858 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 277.0885 |
| Heavy Atoms | 19 |
| Complexity | 511.19443 |
Chemical Identifiers
| CAS Number | 892592-91-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NCCNCC2=CSC=C2)[N+](=O)[O-] |
Product Overview
N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine (CAS 892592-91-5), with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol. IUPAC: N'-(4-nitrophenyl)-N-(thiophen-3-ylmethyl)ethane-1,2-diamine.
Chemical Property Profile of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine
Property Insights of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine
The XLogP value of 2.858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine. Following Lipinski's Rule of Five, N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine has 2 hydrogen bond donor(s) and 5 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-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine?
The CAS number of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine is 892592-91-5.
What is the molecular formula of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine?
The molecular formula of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine is C13H15N3O2S.
What is the molecular weight of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine?
The molecular weight of N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine is 277.09 g/mol.
Where can I buy N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine?
You can request a quote for N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-nitrophenyl)-N'-(thiophen-3-ylmethyl)ethane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.