Vitas-M small molecule compound

3-benzyl-7,7-dimethyl-1-propyl-2,3,4,6,7,8-hexahydroquinazolin-5(1H)-one

Catalog ID
STK217406
SMILES CCCN1CN(Cc2ccccc2)CC2=C1CC(C)(C)CC2=O

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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 C20H28N2O MW 312.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O/c1-4-10-22-15-21(13-16-8-6-5-7-9-16)14-17-18(22)11-20(2,3)12-19(17)23/h5-9H,4,10-15H2,1-3H3
InChIKey
SVAWTCWICWXEFS-UHFFFAOYSA-N
Synonyms

3benzyl77dimethyl1propyl123478hexahydroquinazolin5(6H)onehydrochloride
3benzyl77dimethyl1propyl234678hexahydroquinazolin5(1H)one
3benzyl77dimethyl1propyl2468tetrahydroquinazolin5one
CCCN1CN(CC2=C1CC(CC2=O)(C)C)CC3=CC=CC=C3
CCCN1CN(Cc2ccccc2)CC2=C1CC(C)(C)CC2=OCl
InChI=1SC20H28N2Oc1410221521(13168657916)141718(22)1120(23)1219(17)23h59H41015H213H3
MFCD06595644
ZINC000054177467
ZINC54177467

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.