![(1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride structure](/static/products/354/354772-66-0.png)
(1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride
TL;DR: (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride (CAS 354772-66-0) is a chemical compound with molecular formula C12H14ClFN2O2 and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(1-chloro-2-methylpropylidene)amino] N-[(4-fluorophenyl)methyl]carbamate
Also Known As: (E)-N-(((4-fluorobenzyl)carbamoyl)oxy)isobutyrimidoyl chloride, (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride, [(E)-(1-chloro-2-methylpropylidene)amino] N-[(4-fluorophenyl)methyl]carbamate
| Molecular Formula | C12H14ClFN2O2 |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 3.2602 |
| Topological Polar Surface Area | 50.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.07278 |
| Heavy Atoms | 18 |
| Complexity | 432.20847 |
Chemical Identifiers
| CAS Number | 354772-66-0 |
|---|---|
| SMILES | CC(C)/C(=N\OC(=O)NCC1=CC=C(C=C1)F)/Cl |
Product Overview
(1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride (CAS 354772-66-0), with molecular formula C12H14ClFN2O2 and molecular weight 272.07 g/mol. IUPAC: [(E)-(1-chloro-2-methylpropylidene)amino] N-[(4-fluorophenyl)methyl]carbamate.
Chemical Property Profile of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride
Property Insights of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride
The XLogP value of 3.2602 indicates that (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl 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-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl 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-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride?
The CAS number of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride is 354772-66-0.
What is the molecular formula of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride?
The molecular formula of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride is C12H14ClFN2O2.
What is the molecular weight of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride?
The molecular weight of (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride is 272.07 g/mol.
Where can I buy (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride?
You can request a quote for (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl 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-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for (1E)-N-{[(4-fluorobenzyl)carbamoyl]oxy}-2-methylpropanimidoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.