477712-85-9
Product Name:
ETHYL 1-(5-([(2-CHLOROANILINO)CARBONYL]AMINO)-2-PYRIDINYL)-3,5-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLATE
Formula:
C20H20ClN5O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 413.9 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 413.1254672 g/mol |
| Monoisotopic Mass | 413.1254672 g/mol |
| Topological Polar Surface Area | 98.1 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 580 |
| 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 |