Azd-5122
N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-[[(2R,3R)-3,4-dihydroxybutan-2-yl]amino]pyrimidin-4-yl]azetidine-1-sulfonamide
Molecular Identity
Azd-5122
N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-[[(2R,3R)-3,4-dihydroxybutan-2-yl]amino]pyrimidin-4-yl]azetidine-1-sulfonamide
PubChem CID: 44602493
2D Structure
Properties
C18H23F2N5O4S2
Molecular Formula
475.50
Molecular Weight
g/mol
475.1160
Exact Mass
Da
2.1
XLogP
Drug-like (Lipinski: < 5)
161
TPSA
May have limited oral absorption
4
H-Bond Donors
12
H-Bond Acceptors
670
Complexity
SMILES
Canonical SMILES
SMILES: CC(C(CO)O)NC1=CC(=NC(=N1)SCC2=C(C(=CC=C2)F)F)NS(=O)(=O)N3CCC3Isomeric SMILES
SMILES: C[C@H]([C@H](CO)O)NC1=CC(=NC(=N1)SCC2=C(C(=CC=C2)F)F)NS(=O)(=O)N3CCC3Synonyms(20)
SRT31091204707-71-0SRT-3109AZD-5122AZD51225KT86HK4WXAzd 5122RefChem:116006N-(2-((2,3-difluorobenzyl)thio)-6-(((2R,3R)-3,4-dihydroxybutan-2-yl)amino)pyrimidin-4-yl)azetidine-1-sulfonamideMFCD20040518N-(2-{[(2,3-Difluorophenyl)methyl]sulfanyl}-6-{[(2R,3R)-3,4-dihydroxybutan-2-yl]amino}pyrimidin-4-yl)azetidine-1-sulfonamideC18H23F2N5O4S2N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-[[(2R,3R)-3,4-dihydroxybutan-2-yl]amino]pyrimidin-4-yl]azetidine-1-sulfonamideN-[2-[[(2,3-Difluorophenyl)methyl]thio]-6-[[(1R,2R)-2,3-dihydroxy-1-methylpropyl]amino]-4-pyrimidinyl]-1-azetidinesulfonamideSRT 3109
Data from PubChem (NCBI)
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Drug Network
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