(1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine
TL;DR: (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine (CAS 123767-93-1) is a chemical compound with molecular formula C17H17N3O2 and molecular weight 295.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-N-benzyl-3-benzylimino-2-nitroprop-1-en-1-amine
Also Known As: BAS 01108797, (Z)-N-benzyl-3-benzylimino-2-nitroprop-1-en-1-amine, (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine
| Molecular Formula | C17H17N3O2 |
|---|---|
| Molecular Weight | 295.13 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 295.13208 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 123767-93-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN/C=C(/C=NCC2=CC=CC=C2)\[N+](=O)[O-] |
| InChIKey | RHCOBYPWXYDLLF-OWMXDWKISA-N |
Product Overview
(1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine (CAS 123767-93-1), with molecular formula C17H17N3O2 and molecular weight 295.13 g/mol. IUPAC: (Z)-N-benzyl-3-benzylimino-2-nitroprop-1-en-1-amine.
Chemical Property Profile of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine
Property Insights of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine
The XLogP value of 3.3 indicates that (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine. Following Lipinski's Rule of Five, (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine has 1 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 (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine?
The CAS number of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine is 123767-93-1.
What is the molecular formula of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine?
The molecular formula of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine is C17H17N3O2.
What is the molecular weight of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine?
The molecular weight of (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine is 295.13 g/mol.
Where can I buy (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine?
You can request a quote for (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine?
Yes, KEHONG BIO provides custom synthesis services for (1Z,3E)-N-benzyl-3-(benzylimino)-2-nitroprop-1-en-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.