UC581
TL;DR: UC581 (CAS 165549-69-9) is a chemical compound with molecular formula C14H19ClN2O2S and molecular weight 314.08557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
O-propan-2-yl N-[4-chloro-3-[(E)-propan-2-yloxyiminomethyl]phenyl]carbamothioate
Also Known As: UC581, Carbamothioic acid, S-(1-methylethyl) ester, (4-Chloro-3-(isopropoxyimino-methyl)-phenyl)-thiocarbamic acid, O-isopropyl ester, Carbamothioic acid, (4-chloro-3-(((1-methylethoxy)imino)methyl)phenyl)-, O-(1-methylethyl) ester, 1-Isopropyl [4-chloro-3-[[(1-isopropoxy)imino]methyl]phenyl]carbamothioate
Technical Specifications
| Molecular Formula | C14H19ClN2O2S |
| Molecular Weight | 314.08557 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 314.08557 Da |
| Heavy Atoms | 20 |
| Complexity | 337.0 |
| SMILES | CC(C)OC(=S)NC1=CC(=C(C=C1)Cl)/C=N/OC(C)C |
| InChIKey | PAALNFGWMCOSOL-LZYBPNLTSA-N |
Chemical Property Profile of UC581
Property Insights of UC581
The XLogP value of 4.4 indicates that UC581 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for UC581. Following Lipinski's Rule of Five, UC581 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of UC581?
The CAS number of UC581 is 165549-69-9.
What is the molecular formula of UC581?
The molecular formula of UC581 is C14H19ClN2O2S.
What is the molecular weight of UC581?
The molecular weight of UC581 is 314.08557 g/mol.
Where can I buy UC581?
You can request a quote for UC581 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for UC581?
Yes, CoreyChem provides custom synthesis services for UC581 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.