TL;DR: UC-38 deriv. (CAS 165549-95-1) is a chemical compound with molecular formula C14H19ClN2O3S and molecular weight 330.0805 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-[(2E)-2-methoxyiminopropoxy]phenyl]carbamothioate
Also Known As: UC-38 deriv., Acyclic oxathiin Carboxanilide deriv., Carbamothioic acid, (4-chloro-3-(2-(methoxyimino)propoxy)phenyl)-, O-(1-methylethyl) ester, Carbamothioic acid, [4-chloro-3-[2-(methoxyimino)propoxy]phenyl]-, O-(1-methylethyl) ester, O-isopropyl N-[4-chloro-3-[(2E)-2-methoxyiminopropoxy]phenyl]carbamothioate
| Molecular Formula | C14H19ClN2O3S |
| Molecular Weight | 330.0805 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 330.0805 Da |
| Heavy Atoms | 21 |
| Complexity | 366.0 |
| SMILES | CC(C)OC(=S)NC1=CC(=C(C=C1)Cl)OC/C(=N/OC)/C |
| InChIKey | KXSVLWPNQFSAPP-LICLKQGHSA-N |
The XLogP value of 3.8 indicates that UC-38 deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for UC-38 deriv.. Following Lipinski's Rule of Five, UC-38 deriv. 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 UC-38 deriv. is 165549-95-1.
The molecular formula of UC-38 deriv. is C14H19ClN2O3S.
The molecular weight of UC-38 deriv. is 330.0805 g/mol.
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