Vitas-M small molecule compound
3-(4-chlorophenyl)-5-(3-fluorophenyl)-6,7,8,9,10,11,12,13,14,15-decahydrocyclododeca[e]pyrazolo[1,5-a]pyrimidine
Catalog ID
STK694247
SMILES Clc1ccc(cc1)c1cnn2c1nc(c1cccc(c1)F)c1c2CCCCCCCCCC1
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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 C28H29ClFN3 MW 462.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClFN3/c29-22-16-14-20(15-17-22)25-19-31-33-26-13-8-6-4-2-1-3-5-7-12-24(26)27(32-28(25)33)21-10-9-11-23(30)18-21/h9-11,14-19H,1-8,12-13H2InChIKey
OYYWMABLUSHMRM-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)5(3fluorophenyl)6789101112131415decahydrocyclododeca(e)pyrazolo(15a)pyrimidine
C1CCCCCC2=C(CCCC1)C(=NC3=C(C=NN23)C4=CC=C(C=C4)Cl)C5=CC(=CC=C5)F
InChI=1SC28H29ClFN3c2922161420(151722)251931332613864213571224(26)27(3228(25)33)211091123(30)1821h9111419H181213H2
MFCD12034475
ZINC000035323961
ZINC35323961
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