VPC-70063

Chemical Information
| CAS Number | 13571-44-3 |
| PubChem CID | 4142933 |
| IUPAC Name | 1-benzyl-3-[3,5-bis(trifluoromethyl)phenyl]thiourea |
| Molecular Formula | C16H12F6N2S |
| Molecular Weight | 378.3 |
| XLogP | 4.8 |
| Topological Polar Surface Area | 56.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 423 |
| Property | Value |
|---|---|
| Molecular Weight | 378.3 |
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 378.06253854 |
| Monoisotopic Mass | 378.06253854 |
| Topological Polar Surface Area | 56.2 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 423 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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