691869-11-1
Product Name:
4-[4-(3-CHLOROBENZOYL)-1,4-DIAZEPAN-1-YL]-3-NITROBENZENECARBALDEHYDE O-METHYLOXIME
Formula:
C20H21ClN4O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 416.9 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 416.1251329 g/mol |
| Monoisotopic Mass | 416.1251329 g/mol |
| Topological Polar Surface Area | 91 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 600 |
| 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 |