TL;DR: UC-38 deriv. (CAS 165549-98-4) is a chemical compound with molecular formula C18H26ClNO3S and molecular weight 371.1322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dimethylpentan-3-yl 2-chloro-5-(propan-2-yloxycarbothioylamino)benzoate
Also Known As: UC-38 deriv., Acyclic oxathiin Carboxanilide deriv., Benzoic acid, 2-chloro-5-(((1-methylethoxy)thioxomethyl)amino)-, 2-methyl-1-(1-methylethyl)propyl ester, 2,4-dimethylpentan-3-yl 2-chloro-5-(propan-2-yloxycarbothioylamino)benzoate, (1-isopropyl-2-methyl-propyl) 2-chloro-5-(isopropoxycarbothioylamino)benzoate
| Molecular Formula | C18H26ClNO3S |
| Molecular Weight | 371.1322 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 371.1322 Da |
| Heavy Atoms | 24 |
| Complexity | 420.0 |
| SMILES | CC(C)C(C(C)C)OC(=O)C1=C(C=CC(=C1)NC(=S)OC(C)C)Cl |
| InChIKey | LHZMIBSXENLDCU-UHFFFAOYSA-N |
The XLogP value of 6.1 indicates that UC-38 deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.7 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 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of UC-38 deriv. is 165549-98-4.
The molecular formula of UC-38 deriv. is C18H26ClNO3S.
The molecular weight of UC-38 deriv. is 371.1322 g/mol.
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