860611-53-6
Product Name:
2-(2-(4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]PIPERAZINO)ETHYL)-7-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE
Formula:
C20H19ClF3N5O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 485.8 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 4 |
| Exact Mass | 485.1077663 g/mol |
| Monoisotopic Mass | 485.1077663 g/mol |
| Topological Polar Surface Area | 104 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 719 |
| 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 |