1192667-96-1
Product Name:
ETHYL 2-[(TERT-BUTOXYCARBONYL)AMINO]-3-[(3,5-DICHLOROBENZOYL)SULFANYL]PROPANOATE
Formula:
C17H21Cl2NO5S
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COMPUTED DESCRIPTORS
Molecular Weight | 422.3 g/mol |
---|---|
XLogP3 | 4.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 10 |
Exact Mass | 421.0517493 g/mol |
Monoisotopic Mass | 421.0517493 g/mol |
Topological Polar Surface Area | 107 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 502 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |