N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide

C25H17Cl3N2O4S — CID 11519607

IUPACN-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc(Oc2ccccc2)ccc1NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C25H17Cl3N2O4S/c26-16-6-9-18(10-7-16)29-25(31)21-15-20(34-19-4-2-1-3-5-19)11-13-23(21)30-35(32,33)24-14-17(27)8-12-22(24)28/h1-15,30H,(H,29,31)
InChIKeyLXKONRBOLRDVFS-UHFFFAOYSA-N
MW547.85 g/mol
LogP7.49
Rot. Bonds7

About N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide

N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide (PubChem CID 11519607) has the molecular formula C25H17Cl3N2O4S and a molecular weight of 547.85 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide
PubChem CID11519607
Molecular FormulaC25H17Cl3N2O4S
Molecular Weight547.85 g/mol
Exact Mass546.00
IUPAC NameN-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc(Oc2ccccc2)ccc1NS(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C25H17Cl3N2O4S/c26-16-6-9-18(10-7-16)29-25(31)21-15-20(34-19-4-2-1-3-5-19)11-13-23(21)30-35(32,33)24-14-17(27)8-12-22(24)28/h1-15,30H,(H,29,31)
InChIKeyLXKONRBOLRDVFS-UHFFFAOYSA-N
XLogP7.49
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500547.85
LogP ≤ 57.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[4-(4-chlorophenoxy)phenyl]-2-(naphthalen-2-ylsulfonylamino)benzamide
CID 139818443
4-chloro-3-(methylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
CID 9413651
2-(benzenesulfonamido)-N-(4-phenoxyphenyl)benzamide
CID 3900171
5-acetamido-2-(methanesulfonamido)-N-(4-phenoxyphenyl)benzamide
CID 56516046
2-chloro-5-[[2-[(4-chlorophenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid
CID 10205135
methyl 5-chloro-2-[(2,5-dichlorophenyl)sulfonylamino]benzoate
CID 122187079
2-(benzenesulfonamido)-N-(4-chlorophenyl)benzamide
CID 1243115
2,5-dichloro-N-(2-phenoxy-3-pyridinyl)benzenesulfonamide
CID 155812324
acetic acid;2,4-dichloro-5-[(4-chlorophenyl)sulfamoyl]-N-phenylbenzamide
CID 90484937
5-chloro-2-[(4-chloro-3-nitrophenyl)sulfonylamino]-N-phenylbenzamide
CID 10183406
5-(3-hydroxyphenoxy)-2-(methanesulfonamido)-N-(3,4,5-trichlorophenyl)benzamide
CID 130311644
5-chloro-N-[4-(4-chlorophenoxy)phenyl]-2-hydroxybenzamide
CID 163300797

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide?
The IUPAC name of N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide (CID 11519607) is N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide is O=C(Nc1ccc(Cl)cc1)c1cc(Oc2ccccc2)ccc1NS(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide?
The InChIKey is LXKONRBOLRDVFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17Cl3N2O4S/c26-16-6-9-18(10-7-16)29-25(31)21-15-20(34-19-4-2-1-3-5-19)11-13-23(21)30-35(32,33)24-14-17(27)8-12-22(24)28/h1-15,30H,(H,29,31).
What are the key properties of N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide?
N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide has a molecular weight of 547.85 g/mol, XLogP of 7.49, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[(2,5-dichlorophenyl)sulfonylamino]-5-phenoxybenzamide is sourced from PubChem (CID 11519607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).