(Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide
TL;DR: (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide (CAS 372153-45-2) is a chemical compound with molecular formula C27H27N3O5 and molecular weight 473.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide
Also Known As: (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide, N-[(1Z)-3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide, N-[(Z)-3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide
| Molecular Formula | C27H27N3O5 |
|---|---|
| Molecular Weight | 473.20 g/mol |
| LogP | 4.7169 |
| Topological Polar Surface Area | 110.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 473.19507 |
| Heavy Atoms | 35 |
| Complexity | 1205.0011 |
Chemical Identifiers
| CAS Number | 372153-45-2 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NCC3=CC=CC=C3 |
Product Overview
(Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide (CAS 372153-45-2), with molecular formula C27H27N3O5 and molecular weight 473.20 g/mol. IUPAC: N-[(Z)-3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-(2-methylpropoxy)benzamide.
Chemical Property Profile of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide
Property Insights of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide
The XLogP value of 4.7169 indicates that (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide. Following Lipinski's Rule of Five, (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide 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 (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
The CAS number of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is 372153-45-2.
What is the molecular formula of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
The molecular formula of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is C27H27N3O5.
What is the molecular weight of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
The molecular weight of (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide is 473.20 g/mol.
Where can I buy (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
You can request a quote for (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-N-(3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)-4-isobutoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.