3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide

C20H14Cl2N2O3 — CID 624416

IUPAC3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide
SMILESO=C(Nc1ccc(NC(=O)c2ccccc2O)cc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C20H14Cl2N2O3/c21-16-10-5-12(11-17(16)22)19(26)23-13-6-8-14(9-7-13)24-20(27)15-3-1-2-4-18(15)25/h1-11,25H,(H,23,26)(H,24,27)
InChIKeyVWWLICQSTFMAKB-UHFFFAOYSA-N
MW401.25 g/mol
LogP5.20
Rot. Bonds4

About 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide

3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide (PubChem CID 624416) has the molecular formula C20H14Cl2N2O3 and a molecular weight of 401.25 g/mol. Its IUPAC name is 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide
PubChem CID624416
Molecular FormulaC20H14Cl2N2O3
Molecular Weight401.25 g/mol
Exact Mass400.04
IUPAC Name3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide
SMILESO=C(Nc1ccc(NC(=O)c2ccccc2O)cc1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C20H14Cl2N2O3/c21-16-10-5-12(11-17(16)22)19(26)23-13-6-8-14(9-7-13)24-20(27)15-3-1-2-4-18(15)25/h1-11,25H,(H,23,26)(H,24,27)
InChIKeyVWWLICQSTFMAKB-UHFFFAOYSA-N
XLogP5.20
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.25
LogP ≤ 55.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(4-bromobenzoyl)amino]phenyl]-3,4-dichlorobenzamide
CID 21211970
3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
CID 82885265
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
2-hydroxy-N-phenylbenzamide
CID 157209959
N-[4-(tert-butylamino)phenyl]-3,4-dichlorobenzamide
CID 112984878
N-(3,5-dichloro-4-fluorophenyl)-2-hydroxybenzamide
CID 107575419
3-chloro-N-(4-chloro-3-hydroxyphenyl)-4-hydroxybenzamide
CID 64788669
4-amino-N-(3,4-dichlorophenyl)-3-hydroxybenzamide
CID 107073884
2-hydroxy-N-phenylbenzamide chloride
CID 19021936
3,4-dichloro-N-(3,4-dimethylphenyl)benzamide
CID 677956
2-[(3,4-dichlorophenyl)carbamoyl]benzoate
CID 5106258
3,4-dichloro-N-[4-(methylaminomethyl)phenyl]benzamide
CID 71019742

Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide?
The IUPAC name of 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide (CID 624416) is 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide.
What is the SMILES notation for 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide?
The canonical SMILES for 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide is O=C(Nc1ccc(NC(=O)c2ccccc2O)cc1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide?
The InChIKey is VWWLICQSTFMAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2N2O3/c21-16-10-5-12(11-17(16)22)19(26)23-13-6-8-14(9-7-13)24-20(27)15-3-1-2-4-18(15)25/h1-11,25H,(H,23,26)(H,24,27).
What are the key properties of 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide?
3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide has a molecular weight of 401.25 g/mol, XLogP of 5.20, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-[4-[(2-hydroxybenzoyl)amino]phenyl]benzamide is sourced from PubChem (CID 624416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).