Vitas-M small molecule compound

5-tert-butyl-7-[4-(5-chloro-2-methoxybenzyl)piperazin-1-yl]-3-(4-fluorophenyl)-2-methylpyrazolo[1,5-a]pyrimidine

Catalog ID
STK954750
SMILES COc1ccc(cc1CN1CCN(CC1)c1cc(nc2n1nc(c2c1ccc(cc1)F)C)C(C)(C)C)Cl

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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 C29H33ClFN5O MW 522.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33ClFN5O/c1-19-27(20-6-9-23(31)10-7-20)28-32-25(29(2,3)4)17-26(36(28)33-19)35-14-12-34(13-15-35)18-21-16-22(30)8-11-24(21)37-5/h6-11,16-17H,12-15,18H2,1-5H3
InChIKey
KZSSKQYRDKFFPU-UHFFFAOYSA-N
Synonyms

2((4(5(TERTBUTYL)3(4FLUOROPHENYL)2METHYL(8HYDROPYRAZOLO(15A)PYRIMIDIN7YL))PIPERAZINYL)METHYL)4CHLORO1METHOXYBENZENE
5tertbutyl7(4((5chloro2methoxyphenyl)methyl)piperazin1yl)3(4fluorophenyl)2methylpyrazolo(15a)pyrimidine
5tertbutyl7(4(5chloro2methoxybenzyl)piperazin1yl)3(4fluorophenyl)2methylpyrazolo(15a)pyrimidine
CC1=NN2C(=CC(=NC2=C1C3=CC=C(C=C3)F)C(C)(C)C)N4CCN(CC4)CC5=C(C=CC(=C5)Cl)OC
InChI=1SC29H33ClFN5Oc11927(206923(31)10720)283225(29(23)4)1726(36(28)3319)35141234(131535)18211622(30)81124(21)375h6111617H121518H215H3
MFCD10478925
ZINC000032929405
ZINC32929405

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Available files

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