1041389-29-0
Product Name:
(3S,4aS,8aS)-N-(1,1-DiMethylethyl)decahydro-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-Methylbenzoyl)aMino]-4-(phenylsulfonyl)butyl]-3-isoquinolinecarboxaMide
Formula:
C32H45N3O6S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 599.8 g/mol |
---|---|
XLogP3 | 4.4 |
Hydrogen Bond Donor Count | 4 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 10 |
Exact Mass | 599.30290734 g/mol |
Monoisotopic Mass | 599.30290734 g/mol |
Topological Polar Surface Area | 144 Ų |
Heavy Atom Count | 42 |
Formal Charge | 0 |
Complexity | 1020 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 5 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |