Basic information
- CAS
21662-79-3- Standard SMILES
CCOCC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1- InChIKey
HZSKRKPZUQECIE-UHFFFAOYSA-N- Molecular formula
- C14H17N3O5S
- Average molar mass
- 339.37 g/mol
- Monoisotopic mass
- 339.08889182
Overview
Sulfacecole is a small molecule drug. Sulfacecole has a monoisotopic molecular weight of 339.09 Da.
Names & identifiers
- Preferred name
- Sulfacecole
- IUPAC
- 2-ethoxy-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]acetamide
- English name
- Sulfacecole
- Molecular formula
- C14H17N3O5S
- Molecular weight
- 339.37
Names & synonyms
Sulfacecole21662-79-32-ethoxy-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]acetamideSulfacecole [INN]AP3C1V2UPV2-ETHOXY-N-{4-[(5-METHYL-1,2-OXAZOL-3-YL)SULFAMOYL]PHENYL}ACETAMIDEsulfacecolumSulfacecolUNII-AP3C1V2UPVorb2815200CHEMBL2105536SCHEMBL29387761
Show more names
2-Ethoxy-4'-[(5-methyl-3-isoxazolyl)sulfamoyl]acetanilideAcetamide, 2-ethoxy-N-[4-[[(5-methyl-3-isoxazolyl)amino]sulfonyl]phenyl]-
2-Ethoxy-4'-((5-methyl-3-isoxazolyl)sulfamoyl)acetanilidDTXSID90176046NS00005266T202510Q215472192-Ethoxy-4'-((5-methyl-3-isoxazolyl)sulfamoyl)acetanilide
Database identifiers
- CAS
21662-79-3- PubChem CID
- 178140
- DTXSID
DTXSID90176046- ChEMBL
CHEMBL2105536- UNII
- AP3C1V2UPV
- Nikkaji
- J10.794H
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 485
Physicochemical properties
- Density
- 1.394 · 1.394±0.06 g/cm3(Predicted)
- pka
- 5.59 · 5.59±0.50(Predicted)
- FDA UNII
- 3 C1V2UPV · AP3C1V2UPV
Chemistry & industry
Suppliers1 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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