Vitas-M small molecule compound

3-(3,5-dimethylphenyl)-5-(propan-2-yl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl 2-methylpropanoate

Catalog ID
STK991213
SMILES Cc1cc(C)cc(c1)n1cc(c2c1nc(C(C)C)n1c2nc2c1cccc2)OC(=O)C(C)C

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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 C27H28N4O2 MW 440.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2/c1-15(2)24-29-25-23(26-28-20-9-7-8-10-21(20)31(24)26)22(33-27(32)16(3)4)14-30(25)19-12-17(5)11-18(6)13-19/h7-16H,1-6H3
InChIKey
ISBSUICKXBQCNR-UHFFFAOYSA-N
Synonyms
862210-37-5
3(35dimethylphenyl)5(propan2yl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1yl2methylpropanoate
3(35dimethylphenyl)5isopropyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylisobutyrate
862210375
CC1=CC(=CC(=C1)N2C=C(C3=C2N=C(N4C3=NC5=CC=CC=C54)C(C)C)OC(=O)C(C)C)C
InChI=1SC27H28N4O2c115(2)24292523(2628209781021(20)31(24)26)22(3327(32)16(3)4)1430(25)191217(5)1118(6)1319h716H16H3
MFCD05697840
ZINC000009292154
ZINC09292154
ZINC9292154

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Available files

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