1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]-2-sulfanylethanone
1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]-2-sulfanylethanone
Molecular Identity
1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]-2-sulfanylethanone
1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]-2-sulfanylethanone
PubChem CID: 168059305
2D Structure
Properties
C17H25ClN2OS
Molecular Formula
340.90
Molecular Weight
g/mol
340.1376
Exact Mass
Da
3.7
XLogP
Drug-like (Lipinski: < 5)
24.6
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
367
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)CC1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)CSIsomeric SMILES
SMILES: CC(C)C[C@@H]1CN(CCN1CC2=CC(=CC=C2)Cl)C(=O)CSSynonyms(1)
SVL
Data from PubChem (NCBI)
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Molecular Structure
1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]-2-sulfanylethanone
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Drug Network
Trials and conditions connected to 1-[(3R)-4-[(3-chlorophenyl)methyl]-3-(2-methylpropyl)piperazin-1-yl]-2-sulfanylethanone
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