478029-51-5
Product Name:
17-([4-(TERT-BUTYL)BENZYL]OXY)-17-AZAPENTACYCLO[6.6.5.0(2,7).0(9,14).0(15,19)]NONADECA-2(7),3,5,9(14),10,12-HEXAENE-16,18-DIONE
Formula:
C29H27NO3
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 437.5 g/mol |
---|---|
XLogP3 | 5.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 437.19909372 g/mol |
Monoisotopic Mass | 437.19909372 g/mol |
Topological Polar Surface Area | 46.6 Ų |
Heavy Atom Count | 33 |
Formal Charge | 0 |
Complexity | 708 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |