N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide

C20H14Cl2N2O2 — CID 15991049

IUPACN-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide
SMILESO=C(Nc1cc(NC(=O)c2ccccc2Cl)ccc1Cl)c1ccccc1
InChIInChI=1S/C20H14Cl2N2O2/c21-16-9-5-4-8-15(16)20(26)23-14-10-11-17(22)18(12-14)24-19(25)13-6-2-1-3-7-13/h1-12H,(H,23,26)(H,24,25)
InChIKeyNUJRQMJYQVZHGH-UHFFFAOYSA-N
MW385.25 g/mol
LogP5.50
Rot. Bonds4

About N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide

N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide (PubChem CID 15991049) has the molecular formula C20H14Cl2N2O2 and a molecular weight of 385.25 g/mol. Its IUPAC name is N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide.

Molecular Properties

Compound NameN-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide
PubChem CID15991049
Molecular FormulaC20H14Cl2N2O2
Molecular Weight385.25 g/mol
Exact Mass384.04
IUPAC NameN-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide
SMILESO=C(Nc1cc(NC(=O)c2ccccc2Cl)ccc1Cl)c1ccccc1
InChIInChI=1S/C20H14Cl2N2O2/c21-16-9-5-4-8-15(16)20(26)23-14-10-11-17(22)18(12-14)24-19(25)13-6-2-1-3-7-13/h1-12H,(H,23,26)(H,24,25)
InChIKeyNUJRQMJYQVZHGH-UHFFFAOYSA-N
XLogP5.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.25
LogP ≤ 55.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide?
The IUPAC name of N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide (CID 15991049) is N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide.
What is the SMILES notation for N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide?
The canonical SMILES for N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide is O=C(Nc1cc(NC(=O)c2ccccc2Cl)ccc1Cl)c1ccccc1.
What is the InChIKey of N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide?
The InChIKey is NUJRQMJYQVZHGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2N2O2/c21-16-9-5-4-8-15(16)20(26)23-14-10-11-17(22)18(12-14)24-19(25)13-6-2-1-3-7-13/h1-12H,(H,23,26)(H,24,25).
What are the key properties of N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide?
N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide has a molecular weight of 385.25 g/mol, XLogP of 5.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzamido-4-chlorophenyl)-2-chlorobenzamide is sourced from PubChem (CID 15991049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).