2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide

C10H9F2N3O4S — CID 107915010

IUPAC2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
SMILESCc1nnc(COc2ccc(S(N)(=O)=O)c(F)c2F)o1
InChIInChI=1S/C10H9F2N3O4S/c1-5-14-15-8(19-5)4-18-6-2-3-7(20(13,16)17)10(12)9(6)11/h2-3H,4H2,1H3,(H2,13,16,17)
InChIKeyRYTNTAGGPQAVNI-UHFFFAOYSA-N
MW305.26 g/mol
LogP0.88
Rot. Bonds4

About 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide

2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide (PubChem CID 107915010) has the molecular formula C10H9F2N3O4S and a molecular weight of 305.26 g/mol. Its IUPAC name is 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide.

Molecular Properties

Compound Name2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
PubChem CID107915010
Molecular FormulaC10H9F2N3O4S
Molecular Weight305.26 g/mol
Exact Mass305.03
IUPAC Name2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
SMILESCc1nnc(COc2ccc(S(N)(=O)=O)c(F)c2F)o1
InChIInChI=1S/C10H9F2N3O4S/c1-5-14-15-8(19-5)4-18-6-2-3-7(20(13,16)17)10(12)9(6)11/h2-3H,4H2,1H3,(H2,13,16,17)
InChIKeyRYTNTAGGPQAVNI-UHFFFAOYSA-N
XLogP0.88
TPSA108.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.26
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
The IUPAC name of 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide (CID 107915010) is 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide.
What is the SMILES notation for 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
The canonical SMILES for 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide is Cc1nnc(COc2ccc(S(N)(=O)=O)c(F)c2F)o1.
What is the InChIKey of 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
The InChIKey is RYTNTAGGPQAVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3O4S/c1-5-14-15-8(19-5)4-18-6-2-3-7(20(13,16)17)10(12)9(6)11/h2-3H,4H2,1H3,(H2,13,16,17).
What are the key properties of 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide has a molecular weight of 305.26 g/mol, XLogP of 0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide is sourced from PubChem (CID 107915010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).