![N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide structure](/static/products/6802/680212-60-6.webp)
N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide
TL;DR: N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide (CAS 680212-60-6) is a chemical compound with molecular formula C14H14ClN3O4 and molecular weight 323.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide
Also Known As: N,N-diallyl-N'-(4-chloro-3-nitrobenzoyl)urea, N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide, 1-(4-chloro-3-nitrobenzoyl)-3,3-bis(prop-2-en-1-yl)urea
| Molecular Formula | C14H14ClN3O4 |
|---|---|
| Molecular Weight | 323.07 g/mol |
| LogP | 2.772 |
| Topological Polar Surface Area | 92.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.0673 |
| Heavy Atoms | 22 |
| Complexity | 620.514 |
Chemical Identifiers
| CAS Number | 680212-60-6 |
|---|---|
| SMILES | C=CCN(CC=C)C(=O)NC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-] |
Product Overview
N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide (CAS 680212-60-6), with molecular formula C14H14ClN3O4 and molecular weight 323.07 g/mol. IUPAC: N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide.
Chemical Property Profile of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide
Property Insights of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide
The XLogP value of 2.772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide. The TPSA of 92.55 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide 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 N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide?
The CAS number of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide is 680212-60-6.
What is the molecular formula of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide?
The molecular formula of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide is C14H14ClN3O4.
What is the molecular weight of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide?
The molecular weight of N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide is 323.07 g/mol.
Where can I buy N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide?
You can request a quote for N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[bis(prop-2-enyl)carbamoyl]-4-chloro-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.