K-604
2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridinyl]acetamide
Molecular Identity
K-604
2-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridinyl]acetamide
PubChem CID: 9892288
2D Structure
Properties
C23H30N6OS3
Molecular Formula
502.70
Molecular Weight
g/mol
502.1643
Exact Mass
Da
3.8
XLogP
Drug-like (Lipinski: < 5)
153
TPSA
May have limited oral absorption
2
H-Bond Donors
8
H-Bond Acceptors
623
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CC(=C(C(=N1)SC)NC(=O)CN2CCN(CC2)CCSC3=NC4=CC=CC=C4N3)SCIsomeric SMILES
SMILES: CC1=CC(=C(C(=N1)SC)NC(=O)CN2CCN(CC2)CCSC3=NC4=CC=CC=C4N3)SCSynonyms(20)
K-6042-[4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]piperazin-1-yl]-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]acetamide2-(4-(2-(1H-benzimidazol-2-ylsulfanyl)ethyl)piperazin-1-yl)-N-(6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl)acetamideK604 compoundRefChem:924028561023-90-32-(4-(2-((1H-Benzo[d]imidazol-2-yl)thio)ethyl)piperazin-1-yl)-N-(6-methyl-2,4-bis(methylthio)pyridin-3-yl)acetamideCID 9892288SCHEMBL960484CHEMBL3890942SCHEMBL29845569GTPL10150VGGMTOYKEDKFLN-UHFFFAOYSA-NBDBM182847DTXSID401111183
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to K-604
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