Vitas-M small molecule compound
{3-[5-chloro-4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-6-oxopyridazin-1(6H)-yl]tricyclo[3.3.1.1~3,7~]dec-1-yl}acetic acid
Catalog ID
STK573424
SMILES OC(=O)CC12CC3CC(C1)CC(C2)(C3)n1ncc(c(c1=O)Cl)Nc1ccc2c(c1)OCCO2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H26ClN3O5 MW 471.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN3O5/c25-21-17(27-16-1-2-18-19(6-16)33-4-3-32-18)12-26-28(22(21)31)24-9-14-5-15(10-24)8-23(7-14,13-24)11-20(29)30/h1-2,6,12,14-15,27H,3-5,7-11,13H2,(H,29,30)InChIKey
QGIQWKQZPHNJTQ-UHFFFAOYSA-NSynonyms
900261-06-5(3(5CHLORO4(23DIHYDRO14BENZODIOXIN6YLAMINO)6OXO1(6H)PYRIDAZINYL)1ADAMANTYL)ACETICACID
(3(5chloro4(23dihydro14benzodioxin6ylamino)6oxopyridazin1(6H)yl)tricyclo(3311~37~)dec1yl)aceticacid
2((1r3s5R7S)3(5chloro4((23dihydrobenzo(b)(14)dioxin6yl)amino)6oxopyridazin1(6H)yl)adamantan1yl)aceticacid
2(3(5CHLORO4(23DIHYDRO14BENZODIOXIN6YLAMINO)6OXOPYRIDAZIN1YL)1ADAMANTYL)ACETICACID
900261065
C1COC2=C(O1)C=CC(=C2)NC3=C(C(=O)N(N=C3)C45CC6CC(C4)CC(C6)(C5)CC(=O)O)Cl
InChI=1SC24H26ClN3O5c252117(2716121819(616)33433218)122628(22(21)31)24914515(1024)823(7141324)1120(29)30h12612141527H3571113H2(H2930)
MFCD06610622
ZINC000002350449
Check stock
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Check stock on Vitas-MAvailable files
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