IKT-001PRO
butan-2-yl [1-methyl-4-[[4-[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbamoyl]phenyl]methyl]piperazin-1-ium-1-yl]methyl carbonate;methanesulfonate
Molecular Identity
IKT-001PRO
butan-2-yl [1-methyl-4-[[4-[[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]carbamoyl]phenyl]methyl]piperazin-1-ium-1-yl]methyl carbonate;methanesulfonate
PubChem CID: 165411955
2D Structure
Properties
C36H45N7O7S
Molecular Formula
719.90
Molecular Weight
g/mol
719.3101
Exact Mass
Da
184
TPSA
May have limited oral absorption
2
H-Bond Donors
12
H-Bond Acceptors
1030
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(7)
IKT-001PROWQJ8L8YJ7U1-SEC-BUTOXYCARBONYLOXYMETHYL-1-METHYL-4-(4-(4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYLCARBAMOYL)-BENZYL)-PIPERAZIN-1-IUM MESYLATEMethanesulfonate-1-sec-butoxycarbonyloxymethyl-1-methyl-4-(4-(4-methyl-3-(4-pyridin-3-yl-pyrimidin-2-ylamino)-phenylcarbamoyl)-benzyl)-piperazin-1-iumMethanesulfonate-1-sec-butoxycarbonyloxymethyl-1-methyl-4-{4-[4-methyl-3-(4-pyridin-3-yl-pyrimidin-2-ylamino)-phenylcarbamoyl]-benzyl}-piperazin-1-iumRefChem:201224CHEMBL5314918
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to IKT-001PRO
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