TEMELASTINE

TEMELASTINE

Name: TEMELASTINE

CAS: 86181-44-4 ;86181-42-2

Formula: C21 H24 Br N5 O

Weight: 442.359

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Name: TEMELASTINE
CAS: 86181-44-4 ;86181-42-2
Synonyms: TEMELASTINE ; 4(1H)-PYRIMIDINONE, 2-((4-(5-BROMO-3-METHYL-2-PYRIDINYL)BUTYL)AMINO)-5-((6-METHYL-3-PYRIDINYL)METHYL)-
MDL.: MFCD00865657
H bond acceptor: 6
H bond donor: 2
Smile: Cc1ccc(cn1)Cc2c[nH]c(nc2=O)NCCCCc3c(cc(cn3)Br)C
InChi: InChI=1S/C21H24BrN5O/c1-14-9-18(22)13-25-19(14)5-3-4-8-23-21-26-12-17(20(28)27-21)10-16-7-6-15(2)24-11-16/h6-7,9,11-13H,3-5,8,10H2,1-2H3,(H2,23,26,27,28)
InChiKey: InChIKey=OGEAASSLWZDQBM-UHFFFAOYSA-N