N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine
TL;DR: N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine (CAS 347355-83-3) is a chemical compound with molecular formula C11H16N4O2 and molecular weight 236.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-(2-aminoethyl)-3-N-cyclopropyl-4-nitrobenzene-1,3-diamine
Also Known As: TOS-BB-0552, N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine, A2546/0108369, (2-aminoethyl)[3-(cyclopropylamino)-4-nitrophenyl]amine, {5-[(2-aminoethyl)amino]-2-nitrophenyl}cyclopropylamine
| Molecular Formula | C11H16N4O2 |
|---|---|
| Molecular Weight | 236.13 g/mol |
| LogP | 1.5397 |
| Topological Polar Surface Area | 93.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 236.12732 |
| Heavy Atoms | 17 |
| Complexity | 417.9325 |
Chemical Identifiers
| CAS Number | 347355-83-3 |
|---|---|
| SMILES | C1CC1NC2=C(C=CC(=C2)NCCN)[N+](=O)[O-] |
Product Overview
N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine (CAS 347355-83-3), with molecular formula C11H16N4O2 and molecular weight 236.13 g/mol. IUPAC: 1-N-(2-aminoethyl)-3-N-cyclopropyl-4-nitrobenzene-1,3-diamine.
Chemical Property Profile of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine
Property Insights of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine
The XLogP value of 1.5397 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine. The TPSA of 93.22 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine. Following Lipinski's Rule of Five, N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine has 3 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-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine?
The CAS number of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine is 347355-83-3.
What is the molecular formula of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine?
The molecular formula of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine is C11H16N4O2.
What is the molecular weight of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine?
The molecular weight of N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine is 236.13 g/mol.
Where can I buy N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine?
You can request a quote for N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-aminoethyl)-N-[3-(cyclopropylamino)-4-nitrophenyl]amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.