N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide

C15H11Cl2N3O3S — CID 46933654

IUPACN-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide
SMILESO=S(=O)(Cc1nnc(-c2ccc(Cl)cc2)o1)Nc1ccc(Cl)cc1
InChIInChI=1S/C15H11Cl2N3O3S/c16-11-3-1-10(2-4-11)15-19-18-14(23-15)9-24(21,22)20-13-7-5-12(17)6-8-13/h1-8,20H,9H2
InChIKeyQJZYFNZDAJIFPK-UHFFFAOYSA-N
MW384.24 g/mol
LogP3.99
Rot. Bonds5

About N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide

N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide (PubChem CID 46933654) has the molecular formula C15H11Cl2N3O3S and a molecular weight of 384.24 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide
PubChem CID46933654
Molecular FormulaC15H11Cl2N3O3S
Molecular Weight384.24 g/mol
Exact Mass382.99
IUPAC NameN-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide
SMILESO=S(=O)(Cc1nnc(-c2ccc(Cl)cc2)o1)Nc1ccc(Cl)cc1
InChIInChI=1S/C15H11Cl2N3O3S/c16-11-3-1-10(2-4-11)15-19-18-14(23-15)9-24(21,22)20-13-7-5-12(17)6-8-13/h1-8,20H,9H2
InChIKeyQJZYFNZDAJIFPK-UHFFFAOYSA-N
XLogP3.99
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.24
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide?
The IUPAC name of N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide (CID 46933654) is N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide.
What is the SMILES notation for N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide?
The canonical SMILES for N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide is O=S(=O)(Cc1nnc(-c2ccc(Cl)cc2)o1)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide?
The InChIKey is QJZYFNZDAJIFPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O3S/c16-11-3-1-10(2-4-11)15-19-18-14(23-15)9-24(21,22)20-13-7-5-12(17)6-8-13/h1-8,20H,9H2.
What are the key properties of N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide?
N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide has a molecular weight of 384.24 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methanesulfonamide is sourced from PubChem (CID 46933654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).