1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methyl N-[[(5S)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluorophenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]carbamate

2.1.2 InChI

InChI=1S/C16H19F2N3O6S/c1-26-15(22)19-8-11-9-21(16(23)27-11)10-6-12(17)14(13(18)7-10)20-2-4-28(24,25)5-3-20/h6-7,11H,2-5,8-9H2,1H3,(H,19,22)/t11-/m0/s1

2.1.3 InChI Key

CCYKSCLMFZLAJH-NSHDSACASA-N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Mk-7762

2. A1bwo

3. Tbd09

4. Schembl23847765

5. Gtpl13542

6. Mk7762

7. Methyl N-[[rac-(5s)-3-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3,5-difluoro-phenyl]-2-oxo-oxazolidin-5-yl]methyl]carbamate

2.3 Create Date

2021-11-10

3 Chemical and Physical Properties

Molecular Formula	C₁₆H₁₉F₂N₃O₆S
Molecular Weight	419.4 g/mol
XLogP3	0.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	5
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	114
Heavy Atom Count	28
Formal Charge	0
Complexity	677
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

TBD09

TBD09

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