TL;DR: UC-38 deriv. (CAS 135813-28-4) is a chemical compound with molecular formula C15H20ClNO3S and molecular weight 329.08524 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butan-2-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)-, 1-methylpropyl ester, butan-2-yl 2-chloro-5-(propan-2-yloxycarbothioylamino)benzoate, sec-butyl 2-chloro-5-(isopropoxycarbothioylamino)benzoate
| Molecular Formula | C15H20ClNO3S |
| Molecular Weight | 329.08524 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 79.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 329.08524 Da |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
| SMILES | CCC(C)OC(=O)C1=C(C=CC(=C1)NC(=S)OC(C)C)Cl |
| InChIKey | GGLMEFIHLNDYGX-UHFFFAOYSA-N |
The XLogP value of 4.7 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), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of UC-38 deriv. is 135813-28-4.
The molecular formula of UC-38 deriv. is C15H20ClNO3S.
The molecular weight of UC-38 deriv. is 329.08524 g/mol.
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