5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide

C19H14Cl2N2O3S — CID 92674550

IUPAC5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1cc(NS(=O)(=O)c2ccccc2)ccc1Cl
InChIInChI=1S/C19H14Cl2N2O3S/c20-13-5-4-6-14(11-13)22-19(24)17-12-15(9-10-18(17)21)23-27(25,26)16-7-2-1-3-8-16/h1-12,23H,(H,22,24)
InChIKeyKFZJOWHNFHUZKV-UHFFFAOYSA-N
MW421.31 g/mol
LogP5.05
Rot. Bonds5

About 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide

5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide (PubChem CID 92674550) has the molecular formula C19H14Cl2N2O3S and a molecular weight of 421.31 g/mol. Its IUPAC name is 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide.

Molecular Properties

Compound Name5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide
PubChem CID92674550
Molecular FormulaC19H14Cl2N2O3S
Molecular Weight421.31 g/mol
Exact Mass420.01
IUPAC Name5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide
SMILESO=C(Nc1cccc(Cl)c1)c1cc(NS(=O)(=O)c2ccccc2)ccc1Cl
InChIInChI=1S/C19H14Cl2N2O3S/c20-13-5-4-6-14(11-13)22-19(24)17-12-15(9-10-18(17)21)23-27(25,26)16-7-2-1-3-8-16/h1-12,23H,(H,22,24)
InChIKeyKFZJOWHNFHUZKV-UHFFFAOYSA-N
XLogP5.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.31
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide?
The IUPAC name of 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide (CID 92674550) is 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide.
What is the SMILES notation for 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide?
The canonical SMILES for 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide is O=C(Nc1cccc(Cl)c1)c1cc(NS(=O)(=O)c2ccccc2)ccc1Cl.
What is the InChIKey of 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide?
The InChIKey is KFZJOWHNFHUZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N2O3S/c20-13-5-4-6-14(11-13)22-19(24)17-12-15(9-10-18(17)21)23-27(25,26)16-7-2-1-3-8-16/h1-12,23H,(H,22,24).
What are the key properties of 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide?
5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide has a molecular weight of 421.31 g/mol, XLogP of 5.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide is sourced from PubChem (CID 92674550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).