Name: Name:2,2,2-Trichloro-1-(4,5-dichloro-1H-pyrrol-2-yl)ethanone
Brand: AABLOCKS
SKU: AA006U4Q
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA006U4Q

Chemical Name: 2,2,2-Trichloro-1-(4,5-dichloro-1H-pyrrol-2-yl)ethanone

CAS Number: 50371-51-2

Molecular Formula: C6H2Cl5NO

Molecular Weight: 281.3512

MDL Number: MFCD08691219

SMILES: Clc1[nH]c(cc1Cl)C(=O)C(Cl)(Cl)Cl

Properties

Storage: 2-8℃;

Complexity: 216

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 1

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 4.2

Downstream Synthesis Route

50371-51-2

124-41-4

1197-12-2

[1]Cheng,Ping;Clive,DerrickL.J.;Fernandopulle,Shimal;Chen,Zhenhua[ChemicalCommunications,2013,vol.49,#6,p.558-560]

50371-51-2

106092-09-5

(S)-N-(2-amino-4,5,6,7-tetrahydrobenzo1,2-dthiazol-6-yl)-4,5-dichloro-1H-pyrrole-2-carboxamide

[1]JournalofMedicinalChemistry,2015,vol.58,p.5501-5521

[2]JournalofMedicinalChemistry,2015,vol.58,p.5501-5521

50371-51-2

124-20-9

4,5-dichloro-N-(3'''-((4''-(4',5'-dichloro-1'H-pyrrole-2'-carboxamido)butyl)amino)propyl)-1H-pyrrole-2-carboxamide

[1]Parra,LizbethL.L.;Bertonha,ArianeF.;Severo,IvanR.M.;Aguiar,AnnaC.C.;DeSouza,GuilhermeE.;Oliva,Glaucius;Guido,RafaelV.C.;Grazzia,Nathalia;Costa,TábataR.;Miguel,DaniloC.;Gadelha,FernandaR.;Ferreira,AntonioG.;Hajdu,Eduardo;Romo,Daniel;Berlinck,RobertoG.S.[JournalofNaturalProducts,2018,vol.81,#1,p.188-202]

[2]Barker,David;Lee,Stephanie;Varnava,KyriakosG.;Sparrow,Kevin;vanRensburg,Michelle;Deed,RebeccaC.;Cadelis,MelissaM.;Li,StevenA.;Copp,BrentR.;Sarojini,Vijayalekshmi;Pilkington,LisaI.[Molecules,2020,vol.25,#11]

50371-51-2

13531-52-7

2649465-46-1

[1]Barker,David;Lee,Stephanie;Varnava,KyriakosG.;Sparrow,Kevin;vanRensburg,Michelle;Deed,RebeccaC.;Cadelis,MelissaM.;Li,StevenA.;Copp,BrentR.;Sarojini,Vijayalekshmi;Pilkington,LisaI.[Molecules,2020,vol.25,#11]

50371-51-2

4605-14-5

2649465-58-5

[1]Barker,David;Lee,Stephanie;Varnava,KyriakosG.;Sparrow,Kevin;vanRensburg,Michelle;Deed,RebeccaC.;Cadelis,MelissaM.;Li,StevenA.;Copp,BrentR.;Sarojini,Vijayalekshmi;Pilkington,LisaI.[Molecules,2020,vol.25,#11]

50371-51-2 | 2,2,2-Trichloro-1-(4,5-dichloro-1H-pyrrol-2-yl)ethanone