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Also known as: 2389060-50-6, Linvemastat [inn], Fp2amm4svf, Schembl21577957, Bdbm475517, Ex-a13612

Molecular Formula

C₂₀H₁₇N₃O₄S

Molecular Weight

395.4 g/mol

InChI Key

GUKPADSDFUIAMC-UHFFFAOYSA-N

FDA UNII

FP2AMM4SVF

1 2D Structure

Linvemastat

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-[3-[4-[(2-methyl-4-pyridinyl)methoxy]phenyl]sulfanylfuran-2-yl]imidazolidine-2,4-dione

2.1.2 InChI

InChI=1S/C20H17N3O4S/c1-12-10-13(6-8-21-12)11-27-14-2-4-15(5-3-14)28-16-7-9-26-18(16)17-19(24)23-20(25)22-17/h2-10,17H,11H2,1H3,(H2,22,23,24,25)

2.1.3 InChI Key

GUKPADSDFUIAMC-UHFFFAOYSA-N

2.2 Other Identifiers

2.2.1 UNII

FP2AMM4SVF

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 2389060-50-6

2. Linvemastat [inn]

3. Fp2amm4svf

4. Schembl21577957

5. Bdbm475517

6. Ex-a13612

7. Us10851089, Compound Fc-4

8. Us10851089, Compound Fc-30

9. Us10851089, Compound Fc-31

10. 2,4-imidazolidinedione, 5-[3-[[4-[(2-methyl-4-pyridinyl)methoxy]phenyl]thio]-2-furanyl]-

11. 5-[3-[[4-[(2-methyl-4-pyridinyl)methoxy]phenyl]thio]-2-furanyl]-2,4-imidazolidinedione

12. Rac-(14r)-72-methyl-5-oxa-3-thia-7(4)-pyridina-1(4)-imidazolidina-2(2,3)-furana-4(1,4)-benzenaheptaphane-12,15-dione

2.4 Create Date

2020-06-27

3 Chemical and Physical Properties

Molecular Formula	C₂₀H₁₇N₃O₄S
Molecular Weight	395.4 g/mol
XLogP3	2.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	119
Heavy Atom Count	28
Formal Charge	0
Complexity	570
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

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