Deltasonamide 1
4-N-[(4-chlorophenyl)methyl]-4-N-cyclopentyl-1-N-[[2-(methylamino)pyrimidin-4-yl]methyl]-1-N-(piperidin-4-ylmethyl)benzene-1,4-disulfonamide
Molecular Identity
Deltasonamide 1
4-N-[(4-chlorophenyl)methyl]-4-N-cyclopentyl-1-N-[[2-(methylamino)pyrimidin-4-yl]methyl]-1-N-(piperidin-4-ylmethyl)benzene-1,4-disulfonamide
PubChem CID: 124080849
2D Structure
Properties
C30H39ClN6O4S2
Molecular Formula
647.30
Molecular Weight
g/mol
646.2163
Exact Mass
Da
4.1
XLogP
Drug-like (Lipinski: < 5)
141
TPSA
May have limited oral absorption
2
H-Bond Donors
10
H-Bond Acceptors
1060
Complexity
SMILES
Canonical SMILES
SMILES: CNC1=NC=CC(=N1)CN(CC2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N(CC4=CC=C(C=C4)Cl)C5CCCC5Isomeric SMILES
SMILES: CNC1=NC=CC(=N1)CN(CC2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N(CC4=CC=C(C=C4)Cl)C5CCCC5Synonyms(14)
Deltasonamide 12088485-33-8CHEMBL4472979orb1703521SCHEMBL20379092BDBM50529751AKOS040745732DA-62758MS-30946HY-122641CS-0087780G17930T23976DL3
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Deltasonamide 1
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