TL;DR: RefChem:1068608 (CAS 145071-64-3) is a chemical compound with molecular formula C14H15Cl2N3O3 and molecular weight 343.04904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridin-1-yl] N-(3,4-dichlorophenyl)carbamate
Also Known As: 3-Pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-((((3,4-dichlorophenyl)amino)carbonyl)oxy)-, 3-(O-methyloxime), (E)-, 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridin-1-yl N-(3,4-dichlorophenyl)carbamate, 1-[(3,4-Dichlorophenyl)carbamoyl]oxy-1,2,5,6-tetrahydropyridine-3-carbaldehyde O-methyl oxime, BRN 5827235
| Molecular Formula | C14H15Cl2N3O3 |
| Molecular Weight | 343.04904 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.04904 Da |
| Heavy Atoms | 22 |
| Complexity | 445.0 |
| SMILES | CO/N=C/C1=CCCN(C1)OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
| InChIKey | QHWMBQIDSUDHHK-CAOOACKPSA-N |
The XLogP value of 3.4 indicates that RefChem:1068608 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1068608. Following Lipinski's Rule of Five, RefChem:1068608 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1068608 is 145071-64-3.
The molecular formula of RefChem:1068608 is C14H15Cl2N3O3.
The molecular weight of RefChem:1068608 is 343.04904 g/mol.
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