86717-03-5
Product Name:
2-Propanol, 1-[(4-chlorophenyl)amino]-3-[[5-[(1H-indol-3-ylmethyl)amino]-1,3,4-thiadiazol-2-yl]thio]-
Formula:
C20H20ClN5OS2
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COMPUTED DESCRIPTORS
| Molecular Weight | 446.0 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 445.0797803 g/mol |
| Monoisotopic Mass | 445.0797803 g/mol |
| Topological Polar Surface Area | 139 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 500 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |