Vitas-M small molecule compound
3-cyclopropyl-4-(difluoromethyl)-1-(4-methoxyphenyl)-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazolo[3,4-b]pyridine
Catalog ID
STL400200
SMILES COc1ccc(cc1)n1nc(c2c1nc(cc2C(F)F)C12CC3CC(C2)CC(C1)C3)C1CC1
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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 C27H29F2N3O MW 449.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29F2N3O/c1-33-20-6-4-19(5-7-20)32-26-23(24(31-32)18-2-3-18)21(25(28)29)11-22(30-26)27-12-15-8-16(13-27)10-17(9-15)14-27/h4-7,11,15-18,25H,2-3,8-10,12-14H2,1H3InChIKey
IYNNETYQUZSIQP-UHFFFAOYSA-NSynonyms
1011376-30-91011376309
3cyclopropyl4(difluoromethyl)1(4methoxyphenyl)6(tricyclo(3311~37~)dec1yl)1Hpyrazolo(34b)pyridine
6(1adamantyl)3cyclopropyl4(difluoromethyl)1(4methoxyphenyl)pyrazolo(34b)pyridine
COC1=CC=C(C=C1)N2C3=C(C(=CC(=N3)C45CC6CC(C4)CC(C6)C5)C(F)F)C(=N2)C7CC7
InChI=1SC27H29F2N3Oc133206419(5720)322623(24(3132)182318)21(25(28)29)1122(3026)271215816(1327)1017(915)1427h4711151825H238101214H21H3
ZINC000020603629
ZINC20603629
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