866039-67-0
Product Name:
2-(2-[4-(2,6-DIMETHYLPHENYL)PIPERAZINO]ETHYL)-7-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE
Formula:
C22H26N4O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 410.5 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 410.19540532 g/mol |
| Monoisotopic Mass | 410.19540532 g/mol |
| Topological Polar Surface Area | 90.6 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 609 |
| 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 |