477712-91-7
Product Name:
ETHYL 3,5-DIMETHYL-1-(5-[(4-TOLUIDINOCARBONYL)AMINO]-2-PYRIDINYL)-1H-PYRAZOLE-4-CARBOXYLATE
Formula:
C21H23N5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 393.4 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 393.18008961 g/mol |
| Monoisotopic Mass | 393.18008961 g/mol |
| Topological Polar Surface Area | 98.1 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 567 |
| 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 |