(1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride
TL;DR: (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride (CAS 354772-05-7) is a chemical compound with molecular formula C10H9Cl2FN2O2 and molecular weight 278.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-1-chloropropylideneamino] N-(3-chloro-4-fluorophenyl)carbamate
Also Known As: [(E)-1-chloropropylideneamino] N-(3-chloro-4-fluorophenyl)carbamate|(1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride|(E)-N-(((3-chloro-4-fluorophenyl)carbamoyl)oxy)propionimidoyl chloride
| Molecular Formula | C10H9Cl2FN2O2 |
|---|---|
| Molecular Weight | 278.00 g/mol |
| LogP | 3.9899 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0025 |
| Heavy Atoms | 17 |
| Complexity | 451.93207 |
Chemical Identifiers
| CAS Number | 354772-05-7 |
|---|---|
| SMILES | CC/C(=N\OC(=O)NC1=CC(=C(C=C1)F)Cl)/Cl |
Product Overview
(1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride (CAS 354772-05-7), with molecular formula C10H9Cl2FN2O2 and molecular weight 278.00 g/mol. IUPAC: [(E)-1-chloropropylideneamino] N-(3-chloro-4-fluorophenyl)carbamate.
Chemical Property Profile of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride
Property Insights of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride
The XLogP value of 3.9899 indicates that (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.69 Ų, (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride has 1 hydrogen bond donor(s) and 3 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 (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride?
The CAS number of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride is 354772-05-7.
What is the molecular formula of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride?
The molecular formula of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride is C10H9Cl2FN2O2.
What is the molecular weight of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride?
The molecular weight of (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride is 278.00 g/mol.
Where can I buy (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride?
You can request a quote for (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for (1E)-N-{[(3-chloro-4-fluorophenyl)carbamoyl]oxy}propanimidoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.