TL;DR: UC-38 deriv. (CAS 135813-17-1) is a chemical compound with molecular formula C18H18ClNO3S and molecular weight 363.06958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-methylphenyl) 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-methylphenyl ester, o-tolyl 2-chloro-5-(isopropoxycarbothioylamino)benzoate, (2-methylphenyl) 2-chloro-5-(propan-2-yloxycarbothioylamino)benzoate
| Molecular Formula | C18H18ClNO3S |
| Molecular Weight | 363.06958 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.06958 Da |
| Heavy Atoms | 24 |
| Complexity | 446.0 |
| SMILES | CC1=CC=CC=C1OC(=O)C2=C(C=CC(=C2)NC(=S)OC(C)C)Cl |
| InChIKey | GBRLYUVICMBNOT-UHFFFAOYSA-N |
The XLogP value of 5.2 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 135813-17-1.
The molecular formula of UC-38 deriv. is C18H18ClNO3S.
The molecular weight of UC-38 deriv. is 363.06958 g/mol.
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