3-(2-methoxyethyl)-1-({5-[(4-methylpiperazin-1-yl)methyl]-1-azabicyclo[2.2.2]octan-2-yl}methyl)thiourea
AlkaPlorer ID: AK147577
Synonym: None
IUPAC Name: 1-(2-methoxyethyl)-3-[[(2R,4S,5S)-5-[(4-methylpiperazin-1-yl)methyl]-1-azabicyclo[2.2.2]octan-2-yl]methyl]thiourea
Structure
SMILES: COCCNC(=S)NC[C@H]1C[C@@H]2CCN1C[C@@H]2CN1CCN(C)CC1
InChI: InChI=1S/C18H35N5OS/c1-21-6-8-22(9-7-21)13-16-14-23-5-3-15(16)11-17(23)12-20-18(25)19-4-10-24-2/h15-17H,3-14H2,1-2H3,(H2,19,20,25)/t15-,16-,17+/m0/s1
InChIKey: ULTRDELSKQZNGY-YESZJQIVSA-N
Source
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Properties Information
Molecule Weight: 369.5790000000002
TPSA？: 43.010000000000005
MolLogP？: 0.0547000000000037
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
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