2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide

C18H14ClNO3S — CID 113098760

IUPAC2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1Cl
InChIInChI=1S/C18H14ClNO3S/c19-17-8-4-5-9-18(17)24(21,22)20-14-10-12-16(13-11-14)23-15-6-2-1-3-7-15/h1-13,20H
InChIKeyFFVACEIAQBXYDF-UHFFFAOYSA-N
MW359.83 g/mol
LogP4.93
Rot. Bonds5

About 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide

2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide (PubChem CID 113098760) has the molecular formula C18H14ClNO3S and a molecular weight of 359.83 g/mol. Its IUPAC name is 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide
PubChem CID113098760
Molecular FormulaC18H14ClNO3S
Molecular Weight359.83 g/mol
Exact Mass359.04
IUPAC Name2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1Cl
InChIInChI=1S/C18H14ClNO3S/c19-17-8-4-5-9-18(17)24(21,22)20-14-10-12-16(13-11-14)23-15-6-2-1-3-7-15/h1-13,20H
InChIKeyFFVACEIAQBXYDF-UHFFFAOYSA-N
XLogP4.93
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.83
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(4-phenylmethoxyphenyl)benzenesulfonamide
CID 45369229
N-(4-phenoxyphenyl)naphthalene-1-sulfonamide
CID 134137484
3,4-dichloro-N-(4-phenoxyphenyl)benzenesulfonamide
CID 21210578
N-(2,3-dichlorophenyl)-4-[(4-phenoxyphenyl)sulfonylamino]benzenesulfonamide
CID 43885647
2-chloro-N-[4-(2-chloroethyl)phenyl]benzenesulfonamide
CID 65031108
3-(3,4-dichlorophenyl)sulfonyl-N-(4-phenoxyphenyl)benzenesulfonamide
CID 25048378
2-[4-[(2-chlorophenyl)sulfonylamino]phenyl]acetate
CID 7042231
2-chloro-N-[4-[2-methyl-6-(2-methylimidazol-1-yl)pyrimidin-4-yl]oxyphenyl]benzenesulfonamide
CID 122312728
N-[4-[(2-chlorophenyl)sulfonylamino]phenyl]-2-methylpropanamide
CID 26965668
2-chloro-N-[4-(2-sulfanylacetyl)phenyl]benzenesulfonamide
CID 87732153
4-chloro-N-[4-(4-chlorophenoxy)phenyl]benzenesulfonamide
CID 5010043
N-[3-(2-aminoethoxy)phenyl]-2-chlorobenzenesulfonamide
CID 63120987

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide?
The IUPAC name of 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide (CID 113098760) is 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide?
The canonical SMILES for 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide is O=S(=O)(Nc1ccc(Oc2ccccc2)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide?
The InChIKey is FFVACEIAQBXYDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO3S/c19-17-8-4-5-9-18(17)24(21,22)20-14-10-12-16(13-11-14)23-15-6-2-1-3-7-15/h1-13,20H.
What are the key properties of 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide?
2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide has a molecular weight of 359.83 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-phenoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 113098760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).