253426-24-3
Product Name:
AVE8062A
Formula:
C21H26N2O6.ClH
Synonyms:
(2S)-2-Amino-3-hydroxy-N-[2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]-propanamide hydrochloride;AC 7700;AVE 8062A;AVE8062;Ombrabulin HCl
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 438.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 9 |
| Exact Mass | 438.1557643 g/mol |
| Monoisotopic Mass | 438.1557643 g/mol |
| Topological Polar Surface Area | 112 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 517 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |