220110-87-2
Product Name:
METHYL 4-(4-[(4-METHYLPHENYL)SULFONYL]PIPERAZINO)-3-NITROBENZENECARBOXYLATE
Formula:
C19H21N3O6S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 419.5 g/mol |
---|---|
XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 5 |
Exact Mass | 419.11510657 g/mol |
Monoisotopic Mass | 419.11510657 g/mol |
Topological Polar Surface Area | 121 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 688 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |