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

C10H9Cl2N3O4S — CID 107915004

IUPAC2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
SMILESCc1nnc(COc2ccc(S(N)(=O)=O)c(Cl)c2Cl)o1
InChIInChI=1S/C10H9Cl2N3O4S/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)
InChIKeyLGJOOLDYMDEGMQ-UHFFFAOYSA-N
MW338.17 g/mol
LogP1.91
Rot. Bonds4

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

2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide (PubChem CID 107915004) has the molecular formula C10H9Cl2N3O4S and a molecular weight of 338.17 g/mol. Its IUPAC name is 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide.

Molecular Properties

Compound Name2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
PubChem CID107915004
Molecular FormulaC10H9Cl2N3O4S
Molecular Weight338.17 g/mol
Exact Mass336.97
IUPAC Name2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
SMILESCc1nnc(COc2ccc(S(N)(=O)=O)c(Cl)c2Cl)o1
InChIInChI=1S/C10H9Cl2N3O4S/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)
InChIKeyLGJOOLDYMDEGMQ-UHFFFAOYSA-N
XLogP1.91
TPSA108.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.17
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,3-difluoro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
CID 107915010
2,3-dichloro-4-[(4,5-dimethyl-1,3-thiazol-2-yl)methoxy]benzenesulfonamide
CID 82912874
2,3-dichloro-4-[(4-chlorophenyl)methoxy]benzenesulfonamide
CID 43342544
2,3-dichloro-4-phenylmethoxybenzenesulfonamide
CID 43164582
2,3-dichloro-4-[(1-methylpyrazol-3-yl)methoxy]benzenesulfonamide
CID 82869265
3,5-difluoro-2-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide
CID 107915015
3-(2,3-dichloro-4-sulfamoylphenoxy)-2-methylpropanamide
CID 82913410
2-(2,3-dichloro-4-sulfamoylphenoxy)-N-methylacetamide
CID 82911048
2-chloro-6-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzaldehyde
CID 54919221
2,3-dichloro-4-(3-ethylsulfonylpropoxy)benzenesulfonamide
CID 65098440
2,3-dichloro-4-(3-methylsulfonylpropoxy)benzenesulfonamide
CID 63191807
4-but-2-ynoxy-2,3-dichlorobenzenesulfonamide
CID 82912289

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
The IUPAC name of 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide (CID 107915004) is 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide.
What is the SMILES notation for 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
The canonical SMILES for 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide is Cc1nnc(COc2ccc(S(N)(=O)=O)c(Cl)c2Cl)o1.
What is the InChIKey of 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
The InChIKey is LGJOOLDYMDEGMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3O4S/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-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide?
2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide has a molecular weight of 338.17 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]benzenesulfonamide is sourced from PubChem (CID 107915004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).