N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide

C26H16Cl4N2O2 — CID 5150334

IUPACN-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccccc1-c1ccccc1C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C26H16Cl4N2O2/c27-15-9-11-23(21(29)13-15)31-25(33)19-7-3-1-5-17(19)18-6-2-4-8-20(18)26(34)32-24-12-10-16(28)14-22(24)30/h1-14H,(H,31,33)(H,32,34)
InChIKeyDRRUYRMQOLOKAB-UHFFFAOYSA-N
MW530.24 g/mol
LogP8.47
Rot. Bonds5

About N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide

N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide (PubChem CID 5150334) has the molecular formula C26H16Cl4N2O2 and a molecular weight of 530.24 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
PubChem CID5150334
Molecular FormulaC26H16Cl4N2O2
Molecular Weight530.24 g/mol
Exact Mass528.00
IUPAC NameN-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccccc1-c1ccccc1C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C26H16Cl4N2O2/c27-15-9-11-23(21(29)13-15)31-25(33)19-7-3-1-5-17(19)18-6-2-4-8-20(18)26(34)32-24-12-10-16(28)14-22(24)30/h1-14H,(H,31,33)(H,32,34)
InChIKeyDRRUYRMQOLOKAB-UHFFFAOYSA-N
XLogP8.47
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms34
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.24
LogP ≤ 58.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide (CID 5150334) is N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide is O=C(Nc1ccc(Cl)cc1Cl)c1ccccc1-c1ccccc1C(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide?
The InChIKey is DRRUYRMQOLOKAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16Cl4N2O2/c27-15-9-11-23(21(29)13-15)31-25(33)19-7-3-1-5-17(19)18-6-2-4-8-20(18)26(34)32-24-12-10-16(28)14-22(24)30/h1-14H,(H,31,33)(H,32,34).
What are the key properties of N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide?
N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide has a molecular weight of 530.24 g/mol, XLogP of 8.47, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide is sourced from PubChem (CID 5150334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).