Zibotentan
N-(3-methoxy-5-methylpyrazin-2-yl)-2-[4-(1,3,4-oxadiazol-2-yl)phenyl]pyridine-3-sulfonamide
Molecular Identity
Zibotentan
N-(3-methoxy-5-methylpyrazin-2-yl)-2-[4-(1,3,4-oxadiazol-2-yl)phenyl]pyridine-3-sulfonamide
PubChem CID: 9910224
Zibotentan is a member of the class of pyridinesulfonamides that is benzene substituted by 3-[(3-methoxy-5-methylpyrazin-2-yl)sulfamoyl]pyridin-2-yl and 1,3,4-oxadiazol-2-yl groups at positions 1 and 4, respectively. It is an endothelin A receptor antagonist with potential antineoplastic activity. It has a role as an antineoplastic agent, an antihypertensive agent and an endothelin A receptor antagonist. It is a member of benzenes, an aromatic ether, a phenylpyridine, a member of pyrazines, a member of 1,3,4-oxadiazoles and a pyridinesulfonamide.
2D Structure
Properties
C19H16N6O4S
Molecular Formula
424.40
Molecular Weight
g/mol
424.0954
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
141
TPSA
May have limited oral absorption
1
H-Bond Donors
10
H-Bond Acceptors
654
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CN=C(C(=N1)OC)NS(=O)(=O)C2=C(N=CC=C2)C3=CC=C(C=C3)C4=NN=CO4Isomeric SMILES
SMILES: CC1=CN=C(C(=N1)OC)NS(=O)(=O)C2=C(N=CC=C2)C3=CC=C(C=C3)C4=NN=CO4Synonyms(20)
Zibotentan186497-07-4ZD4054N-(3-METHOXY-5-METHYLPYRAZIN-2-YL)-2-[4-(1,3,4-OXADIAZOL-2-YL)PHENYL]PYRIDINE-3-SULFONAMIDEZD-4054Zd 40548054MM4902DTXSID708701713-Pyridinesulfonamide, N-(3-methoxy-5-methylpyrazinyl)-2-(4-(1,3,4-oxadiazol-2-yl)phenyl)-N-(3-METHOXY-5-METHYLPYRAZIN-2-YL)-2-(4-(1,3,4-OXADIAZOL-2-YL)PHENYL)PRIDINE-3-SULFONAMIDEzibotentanumN-(3-Methoxy-5-methylpyrazin-2-yl)-2-(4-(1,3,4-oxadiazol-2-yl)phenyl)pyridine-3-sulfonamideN-(3-Methoxy-5-Methylpyrazin-2-Yl)-2-(4-[1,3,4-Oxadiazol-2-Yl]Phenyl)Pyridine-3-SulfonamideRefChem:904857DTXCID20817970
Data from PubChem (NCBI)
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