basic_info |
|
| Product_Name: | 8-AZEPAN-1-YL-7-(2-BROMO-BENZYL)-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| EnglishSynonyms: | 8-AZEPAN-1-YL-7-(2-BROMO-BENZYL)-3-METHYL-3,7-DIHYDRO-PURINE-2,6-DIONE |
| pro_mdlNumber: | MFCD02666242 |
| pro_acceptors: | 7 |
| pro_donors: | 1 |
| pro_smile: | Cn1c2c(c(=O)[nH]c1=O)n(c(n2)N3CCCCCC3)Cc4ccccc4Br |
| InChi: | InChI=1S/C19H22BrN5O2/c1-23-16-15(17(26)22-19(23)27)25(12-13-8-4-5-9-14(13)20)18(21-16)24-10-6-2-3-7-11-24/h4-5,8-9H,2-3,6-7,10-12H2,1H3,(H,22,26,27) |
| InChiKey: | InChIKey=CDTLSTCSJXCXPT-UHFFFAOYSA-N |
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