4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride

C22H17Cl2N3O — CID 162317763

IUPAC4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride
SMILESCl.O=C(Nc1cccc(-c2cnc(-c3ccccc3)[nH]2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C22H16ClN3O.ClH/c23-18-11-9-16(10-12-18)22(27)25-19-8-4-7-17(13-19)20-14-24-21(26-20)15-5-2-1-3-6-15;/h1-14H,(H,24,26)(H,25,27);1H
InChIKeyDJGIUWKZOLYVMR-UHFFFAOYSA-N
MW410.30 g/mol
LogP6.07
Rot. Bonds4

About 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride

4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride (PubChem CID 162317763) has the molecular formula C22H17Cl2N3O and a molecular weight of 410.30 g/mol. Its IUPAC name is 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride.

Molecular Properties

Compound Name4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride
PubChem CID162317763
Molecular FormulaC22H17Cl2N3O
Molecular Weight410.30 g/mol
Exact Mass409.07
IUPAC Name4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride
SMILESCl.O=C(Nc1cccc(-c2cnc(-c3ccccc3)[nH]2)c1)c1ccc(Cl)cc1
InChIInChI=1S/C22H16ClN3O.ClH/c23-18-11-9-16(10-12-18)22(27)25-19-8-4-7-17(13-19)20-14-24-21(26-20)15-5-2-1-3-6-15;/h1-14H,(H,24,26)(H,25,27);1H
InChIKeyDJGIUWKZOLYVMR-UHFFFAOYSA-N
XLogP6.07
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.30
LogP ≤ 56.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[5-[3-[(3,4-dichlorophenyl)carbamoylamino]phenyl]-1H-imidazol-2-yl]benzamide
CID 154687110
6-morpholin-4-yl-N-[3-(5-phenyl-1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide
CID 24788780
N-[4-(2-amino-1H-imidazol-5-yl)phenyl]-4-chlorobenzamide;hydrochloride
CID 118711437
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3-benzamido-N-(5-chloro-2-pyridinyl)benzamide
CID 3929829
N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]quinoline-3-carboxamide
CID 24789075
N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-6-phenoxypyridine-3-carboxamide
CID 58006536
N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]-5-fluoropyridine-3-carboxamide
CID 58006446
2,3-dichloro-N-[4-chloro-3-(5-phenyl-1H-imidazol-2-yl)phenyl]benzamide
CID 58006486
N-[3-[3-(aminomethyl)phenyl]phenyl]-4-chlorobenzamide
CID 11396784
N-[6-[(4-chlorophenyl)sulfamoyl]-2-pyridinyl]-2-phenyl-1H-imidazole-5-carboxamide
CID 166748213
N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride?
The IUPAC name of 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride (CID 162317763) is 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride.
What is the SMILES notation for 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride?
The canonical SMILES for 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride is Cl.O=C(Nc1cccc(-c2cnc(-c3ccccc3)[nH]2)c1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride?
The InChIKey is DJGIUWKZOLYVMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClN3O.ClH/c23-18-11-9-16(10-12-18)22(27)25-19-8-4-7-17(13-19)20-14-24-21(26-20)15-5-2-1-3-6-15;/h1-14H,(H,24,26)(H,25,27);1H.
What are the key properties of 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride?
4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride has a molecular weight of 410.30 g/mol, XLogP of 6.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[3-(2-phenyl-1H-imidazol-5-yl)phenyl]benzamide;hydrochloride is sourced from PubChem (CID 162317763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).