Vitas-M small molecule compound

5-(4-fluorophenyl)-3-hexyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 4-fluorobenzoate

Catalog ID
STL347689
SMILES CCCCCCn1cc(c2c1nc(c1ccc(cc1)F)n1c2nc2c1cccc2)OC(=O)c1ccc(cc1)F

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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 C31H26F2N4O2 MW 524.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26F2N4O2/c1-2-3-4-7-18-36-19-26(39-31(38)21-12-16-23(33)17-13-21)27-29(36)35-28(20-10-14-22(32)15-11-20)37-25-9-6-5-8-24(25)34-30(27)37/h5-6,8-17,19H,2-4,7,18H2,1H3
InChIKey
PMZRGOICSDBBON-UHFFFAOYSA-N
Synonyms
861138-88-7
5(4fluorophenyl)3hexyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1yl4fluorobenzoate
5(4fluorophenyl)3hexyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl4fluorobenzoate
861138887
CCCCCCN1C=C(C2=C1N=C(N3C2=NC4=CC=CC=C43)C5=CC=C(C=C5)F)OC(=O)C6=CC=C(C=C6)F
InChI=1SC31H26F2N4O2c1234718361926(3931(38)21121623(33)171321)2729(36)3528(20101422(32)151120)3725965824(25)3430(27)37h5681719H24718H21H3
MFCD05683719
ZINC000009307926
ZINC09307926
ZINC9307926

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Available files

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