633322-14-2
Product Name:
1-Piperazinecarbothioamide, N-[(4-chlorophenyl)methyl]-4-(1H-indol-6-ylcarbonyl)-
Formula:
C21H21ClN4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 412.9 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 412.1124602 g/mol |
| Monoisotopic Mass | 412.1124602 g/mol |
| Topological Polar Surface Area | 83.5 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 561 |
| 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 |