![{[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate structure](/static/products/3898/389810-92-8.webp)
{[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
TL;DR: {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate (CAS 389810-92-8) is a chemical compound with molecular formula C16H16ClN3O3 and molecular weight 333.088 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[4-(dimethylamino)anilino]-2-oxoethyl] 2-chloropyridine-3-carboxylate
Also Known As: AB00770529-01, [2-[4-(dimethylamino)anilino]-2-oxoethyl] 2-chloropyridine-3-carboxylate, {[4-(dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate, 2-{[4-(dimethylamino)phenyl]amino}-2-oxoethyl 2-chloropyridine-3-carboxylate
Technical Specifications
| Molecular Formula | C16H16ClN3O3 |
| Molecular Weight | 333.088 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 71.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.088 Da |
| Heavy Atoms | 23 |
| Complexity | 411.0 |
| SMILES | CN(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=C(N=CC=C2)Cl |
| InChIKey | QHXSEODGOIRKDM-UHFFFAOYSA-N |
Chemical Property Profile of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
Property Insights of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
The CAS number of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate is 389810-92-8.
What is the molecular formula of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
The molecular formula of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate is C16H16ClN3O3.
What is the molecular weight of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
The molecular weight of {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate is 333.088 g/mol.
Where can I buy {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
You can request a quote for {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for {[4-(Dimethylamino)phenyl]carbamoyl}methyl 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.