810695-75-1
Product Name:
1-methyl-3-[(E)-(5-nitro-2-pyridin-2-ylsulfanylphenyl)methylideneamino]thiourea
Formula:
C14H13N5O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 347.4 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 347.05106702 g/mol |
| Monoisotopic Mass | 347.05106702 g/mol |
| Topological Polar Surface Area | 153 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 443 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |