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SML2278

NDT9513727

≥98% (HPLC)

Synonym(s):

N,N-bis(1,3-Benzodioxol-5-ylmethyl)-1-butyl-2,4-diphenyl-1Himidazole-5-methanamine, NDT-9513727

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About This Item

Empirical Formula (Hill Notation):
C36H35N3O4
CAS Number:
439571-48-9
Molecular Weight:
573.68
UNSPSC Code:
12352200
NACRES:
NA.77
MDL number:
MFCD22683794
Assay:
≥98% (HPLC)
Form:
powder
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assay

≥98% (HPLC)

form

powder

color

white to beige

solubility

DMSO: 2 mg/mL, clear

storage temp.

2-8°C

SMILES string

CCCCN1C(CN(CC2=CC=C3OCOC3=C2)CC4=CC5=C(C=C4)OCO5)=C(N=C1C6=CC=CC=C6)C7=CC=CC=C7

InChI

1S/C36H35N3O4/c1-2-3-18-39-30(35(28-10-6-4-7-11-28)37-36(39)29-12-8-5-9-13-29)23-38(21-26-14-16-31-33(19-26)42-24-40-31)22-27-15-17-32-34(20-27)43-25-41-32/h4-17,19-20H,2-3,18,21-25H2,1H3

InChI key

ITACCRHKSPSKKL-UHFFFAOYSA-N

Biochem/physiol Actions

C5a receptor inverse agonist
NDT 9513727 is novel potent, selective and orally available C5a receptor inverse agonist.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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