Vitas-M small molecule compound

3-hexyl-9-(3-methoxyphenyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione

Catalog ID
STL004891
SMILES CCCCCCn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)c1cccc(c1)OC

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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 C22H29N5O3 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O3/c1-4-5-6-7-12-27-20(28)18-19(24(2)22(27)29)23-21-25(13-9-14-26(18)21)16-10-8-11-17(15-16)30-3/h8,10-11,15H,4-7,9,12-14H2,1-3H3
InChIKey
GEVNCYFPDJASNQ-UHFFFAOYSA-N
Synonyms
844836-39-1
3HEXYL9(3METHOXYPHENYL)1METHYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3hexyl9(3methoxyphenyl)1methyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
3HEXYL9(3METHOXYPHENYL)1METHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
844836391
CCCCCCN1C(=O)C2=C(N=C3N2CCCN3C4=CC(=CC=C4)OC)N(C1=O)C
InChI=1SC22H29N5O3c14567122720(28)1819(24(2)22(27)29)232125(1391426(18)21)161081117(1516)303h8101115H4791214H213H3
MFCD04164105
ZINC000008625404
ZINC08625404
ZINC8625404

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Available files

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