4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioic S-acid
4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioic S-acid
Molecular Identity
4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioic S-acid
4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioic S-acid
PubChem CID: 449369
2D Structure
Properties
C10H11IO4S
Molecular Formula
354.16
Molecular Weight
g/mol
353.9423
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
56.8
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
5
H-Bond Acceptors
263
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C(=C(C(=C1I)O)OC)OC)C(=O)SIsomeric SMILES
SMILES: CC1=C(C(=C(C(=C1I)O)OC)OC)C(=O)SSynonyms(1)
HIB
Data from PubChem (NCBI)
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Molecular Structure
4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioic S-acid
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Drug Network
Trials and conditions connected to 4-hydroxy-5-iodo-2,3-dimethoxy-6-methylbenzenecarbothioic S-acid
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