Molecules/(3aS,4S,6aR)-4-(5-{1-[(3-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}pentyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
(3aS,4S,6aR)-4-(5-{1-[(3-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}pentyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
(3aS,4S,6aR)-4-[5-[1-[(3-fluorophenyl)methyl]triazol-4-yl]pentyl]-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-2-one
Molecular Identity
(3aS,4S,6aR)-4-(5-{1-[(3-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}pentyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
(3aS,4S,6aR)-4-[5-[1-[(3-fluorophenyl)methyl]triazol-4-yl]pentyl]-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-2-one
PubChem CID: 132274779
2D Structure
Properties
C19H24FN5OS
Molecular Formula
389.50
Molecular Weight
g/mol
389.1686
Exact Mass
Da
2.8
XLogP
Drug-like (Lipinski: < 5)
97.1
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
512
Complexity
SMILES
Canonical SMILES
SMILES: C1C2C(C(S1)CCCCCC3=CN(N=N3)CC4=CC(=CC=C4)F)NC(=O)N2Isomeric SMILES
SMILES: C1[C@H]2[C@@H]([C@@H](S1)CCCCCC3=CN(N=N3)CC4=CC(=CC=C4)F)NC(=O)N2Synonyms(4)
CHEMBL3968104(3aS,4S,6aR)-4-(5-{1-[(3-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}pentyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-oneBDBM50201198BVY
Data from PubChem (NCBI)
This platform is for informational purposes only and does not constitute medical advice. Always consult a qualified healthcare professional.
Molecular Structure
(3aS,4S,6aR)-4-(5-{1-[(3-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}pentyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
Loading structure...
Drug Network
Trials and conditions connected to (3aS,4S,6aR)-4-(5-{1-[(3-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}pentyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
Loading drug network...