![2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide structure](/static/products/806/80687-20-3.png)
2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide
TL;DR: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide (CAS 80687-20-3) is a chemical compound with molecular formula C19H21ClN4O3 and molecular weight 388.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide
Also Known As: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide, Nalpha-[(2-Chloroethyl)(nitroso)carbamoyl]-N-(4-methylphenyl)phenylalaninamide
| Molecular Formula | C19H21ClN4O3 |
|---|---|
| Molecular Weight | 388.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.13022 |
| Heavy Atoms | 27 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 80687-20-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)N(CCCl)N=O |
| InChIKey | DCECXOAALIGOCC-UHFFFAOYSA-N |
Product Overview
2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide (CAS 80687-20-3), with molecular formula C19H21ClN4O3 and molecular weight 388.13 g/mol. IUPAC: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide.
Chemical Property Profile of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide
Property Insights of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide
The XLogP value of 3.7 indicates that 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide. Following Lipinski's Rule of Five, 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide has 2 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 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide?
The CAS number of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide is 80687-20-3.
What is the molecular formula of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide?
The molecular formula of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide is C19H21ClN4O3.
What is the molecular weight of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide?
The molecular weight of 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide is 388.13 g/mol.
Where can I buy 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide?
You can request a quote for 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.