3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide

C15H10Cl2N2O3S — CID 3844414

IUPAC3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-c2cnco2)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H10Cl2N2O3S/c16-11-5-12(17)7-14(6-11)23(20,21)19-13-3-1-10(2-4-13)15-8-18-9-22-15/h1-9,19H
InChIKeyXMEWECBJZOPGCV-UHFFFAOYSA-N
MW369.23 g/mol
LogP4.45
Rot. Bonds4

About 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide

3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide (PubChem CID 3844414) has the molecular formula C15H10Cl2N2O3S and a molecular weight of 369.23 g/mol. Its IUPAC name is 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
PubChem CID3844414
Molecular FormulaC15H10Cl2N2O3S
Molecular Weight369.23 g/mol
Exact Mass367.98
IUPAC Name3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(-c2cnco2)cc1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H10Cl2N2O3S/c16-11-5-12(17)7-14(6-11)23(20,21)19-13-3-1-10(2-4-13)15-8-18-9-22-15/h1-9,19H
InChIKeyXMEWECBJZOPGCV-UHFFFAOYSA-N
XLogP4.45
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.23
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
The IUPAC name of 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide (CID 3844414) is 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide.
What is the SMILES notation for 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
The canonical SMILES for 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide is O=S(=O)(Nc1ccc(-c2cnco2)cc1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
The InChIKey is XMEWECBJZOPGCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O3S/c16-11-5-12(17)7-14(6-11)23(20,21)19-13-3-1-10(2-4-13)15-8-18-9-22-15/h1-9,19H.
What are the key properties of 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide?
3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide has a molecular weight of 369.23 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[4-(1,3-oxazol-5-yl)phenyl]benzenesulfonamide is sourced from PubChem (CID 3844414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).