N-({5-[1-methyl-3-(thiophen-2-yl)-1H-pyrazol-5-yl]-1-azabicyclo[2.2.2]octan-2-yl}methyl)morpholine-4-carboxamide
AlkaPlorer ID: AK168760
Synonym: None
IUPAC Name: N-[[(2R,4S,5R)-5-(2-methyl-5-thiophen-2-ylpyrazol-3-yl)-1-azabicyclo[2.2.2]octan-2-yl]methyl]morpholine-4-carboxamide
Structure
SMILES: CN1N=C(C2=CC=CS2)C=C1[C@H]1CN2CC[C@H]1C[C@@H]2CNC(=O)N1CCOCC1
InChI: InChI=1S/C21H29N5O2S/c1-24-19(12-18(23-24)20-3-2-10-29-20)17-14-26-5-4-15(17)11-16(26)13-22-21(27)25-6-8-28-9-7-25/h2-3,10,12,15-17H,4-9,11,13-14H2,1H3,(H,22,27)/t15-,16+,17-/m0/s1
InChIKey: QUQCYMIMHLOSGW-BBWFWOEESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 415.5630000000003
TPSA？: 62.63000000000001
MolLogP？: 2.3682
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|