Vitas-M small molecule compound

3-(2-chloro-6-fluorobenzyl)-8-(3-methoxypropyl)-1,6,7-trimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione

Catalog ID
STK576779
SMILES COCCCn1c(C)c(n2c1nc1c2c(=O)n(c(=O)n1C)Cc1c(F)cccc1Cl)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 C21H23ClFN5O3 MW 447.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClFN5O3/c1-12-13(2)28-17-18(24-20(28)26(12)9-6-10-31-4)25(3)21(30)27(19(17)29)11-14-15(22)7-5-8-16(14)23/h5,7-8H,6,9-11H2,1-4H3
InChIKey
GDWZAZMPNWTWRI-UHFFFAOYSA-N
Synonyms
876675-61-5
2((2CHLORO6FLUOROPHENYL)METHYL)6(3METHOXYPROPYL)478TRIMETHYLPURINO(78A)IMIDAZOLE13DIONE
3((6CHLORO2FLUOROPHENYL)METHYL)8(3METHOXYPROPYL)167TRIMETHYL135TRIHYDRO4IMIDAZOLINO(12H)PURINE24DIONE
3(2chloro6fluorobenzyl)8(3methoxypropyl)167trimethyl1Himidazo(21f)purine24(3H8H)dione
876675615
CC1=C(N2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CC4=C(C=CC=C4Cl)F)C)C
InChI=1SC21H23ClFN5O3c11213(2)281718(2420(28)26(12)9610314)25(3)21(30)27(19(17)29)111415(22)75816(14)23h578H6911H214H3
MFCD06785324
ZINC000006300117
ZINC06300117
ZINC6300117

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Available files

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