Name: Name:N-[(1,1-Dimethylethoxy)carbonyl]-n-methyl-l-alanyl-l-valine
Brand: AABLOCKS
SKU: AA00IEN1
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00IEN1

Chemical Name: N-[(1,1-Dimethylethoxy)carbonyl]-n-methyl-l-alanyl-l-valine

CAS Number: 876622-63-8

Molecular Formula: C14H26N2O5

Molecular Weight: 302.3666

MDL Number: MFCD22741597

SMILES: CC(C)C(C(=O)O)NC(=O)C(C)N(C)C(=O)OC(C)(C)C

Properties

Complexity: 401

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 2

Heavy Atom Count: 21

Hydrogen Bond Acceptor Count: 5

Hydrogen Bond Donor Count: 2

Rotatable Bond Count: 7

XLogP3: 1.8

Downstream Synthesis Route

178734-54-8

876622-63-8

[1]Hennessy,EdwardJ.;Adam,Ammar;Aquila,BrianM.;Castriotta,LillianM.;Cook,Donald;Hattersley,Maureen;Hird,AlexanderW.;Huntington,Christopher;Kamhi,VictorM.;Laing,NaomiM.;Li,Danyang;MacIntyre,Terry;Omer,CharlesA.;Oza,Vibha;Patterson,Troy;Repik,Galina;Rooney,MichaelT.;Saeh,JamalC.;Sha,Li;Vasbinder,MelissaM.;Wang,Haiyun;Whitston,David[JournalofMedicinalChemistry,2013,vol.56,#24,p.9897-9919]

[2]CurrentPatentAssignee:IDUNPHARMACEUTICALS,INC.-WO2006/17295,2006,A2Locationinpatent:Page/Pagecolumn132

876622-63-8

1381993-20-9

1381993-21-0

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2012/80271,2012,A1Locationinpatent:Page/Pagecolumn49-50

16948-16-6

876622-63-8

[1]Hennessy,EdwardJ.;Adam,Ammar;Aquila,BrianM.;Castriotta,LillianM.;Cook,Donald;Hattersley,Maureen;Hird,AlexanderW.;Huntington,Christopher;Kamhi,VictorM.;Laing,NaomiM.;Li,Danyang;MacIntyre,Terry;Omer,CharlesA.;Oza,Vibha;Patterson,Troy;Repik,Galina;Rooney,MichaelT.;Saeh,JamalC.;Sha,Li;Vasbinder,MelissaM.;Wang,Haiyun;Whitston,David[JournalofMedicinalChemistry,2013,vol.56,#24,p.9897-9919]

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2014/56755,2014,A1

[3]Shimizu,Hiroki;Renslo,AdamR.[ChemMedChem,2022,vol.17,#16]

876622-63-8

1514922-97-4

1514923-35-3

[1]Hennessy,EdwardJ.;Adam,Ammar;Aquila,BrianM.;Castriotta,LillianM.;Cook,Donald;Hattersley,Maureen;Hird,AlexanderW.;Huntington,Christopher;Kamhi,VictorM.;Laing,NaomiM.;Li,Danyang;MacIntyre,Terry;Omer,CharlesA.;Oza,Vibha;Patterson,Troy;Repik,Galina;Rooney,MichaelT.;Saeh,JamalC.;Sha,Li;Vasbinder,MelissaM.;Wang,Haiyun;Whitston,David[JournalofMedicinalChemistry,2013,vol.56,#24,p.9897-9919]

6306-52-1

876622-63-8

[1]Hennessy,EdwardJ.;Adam,Ammar;Aquila,BrianM.;Castriotta,LillianM.;Cook,Donald;Hattersley,Maureen;Hird,AlexanderW.;Huntington,Christopher;Kamhi,VictorM.;Laing,NaomiM.;Li,Danyang;MacIntyre,Terry;Omer,CharlesA.;Oza,Vibha;Patterson,Troy;Repik,Galina;Rooney,MichaelT.;Saeh,JamalC.;Sha,Li;Vasbinder,MelissaM.;Wang,Haiyun;Whitston,David[JournalofMedicinalChemistry,2013,vol.56,#24,p.9897-9919]

876622-63-8 | N-[(1,1-Dimethylethoxy)carbonyl]-n-methyl-l-alanyl-l-valine