5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide

C22H18Cl2N2O4 — CID 17111377

IUPAC5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide
SMILESCOc1cc(NC(=O)c2cc(Cl)ccc2OC)ccc1NC(=O)c1ccccc1Cl
InChIInChI=1S/C22H18Cl2N2O4/c1-29-19-10-7-13(23)11-16(19)22(28)25-14-8-9-18(20(12-14)30-2)26-21(27)15-5-3-4-6-17(15)24/h3-12H,1-2H3,(H,25,28)(H,26,27)
InChIKeyITDRPECQPBOOJQ-UHFFFAOYSA-N
MW445.30 g/mol
LogP5.52
Rot. Bonds6

About 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide

5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide (PubChem CID 17111377) has the molecular formula C22H18Cl2N2O4 and a molecular weight of 445.30 g/mol. Its IUPAC name is 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide
PubChem CID17111377
Molecular FormulaC22H18Cl2N2O4
Molecular Weight445.30 g/mol
Exact Mass444.06
IUPAC Name5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide
SMILESCOc1cc(NC(=O)c2cc(Cl)ccc2OC)ccc1NC(=O)c1ccccc1Cl
InChIInChI=1S/C22H18Cl2N2O4/c1-29-19-10-7-13(23)11-16(19)22(28)25-14-8-9-18(20(12-14)30-2)26-21(27)15-5-3-4-6-17(15)24/h3-12H,1-2H3,(H,25,28)(H,26,27)
InChIKeyITDRPECQPBOOJQ-UHFFFAOYSA-N
XLogP5.52
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500445.30
LogP ≤ 55.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dichloro-N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]benzamide
CID 17115543
2-chloro-N-[4-[[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino]-2-methoxyphenyl]benzamide
CID 17117613
2-chloro-N-[4-[[2-(4-chlorophenoxy)acetyl]amino]-2-methoxyphenyl]benzamide
CID 17111369
2-chloro-N-[2-methoxy-4-[(4-propan-2-yloxybenzoyl)amino]phenyl]benzamide
CID 1319753
5-chloro-N-(3,4-difluorophenyl)-2-methoxybenzamide
CID 842280
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324
N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-5-(2,5-dichlorophenyl)furan-2-carboxamide
CID 17317119
5-chloro-N-[3-[(2-chlorophenyl)sulfamoyl]-4-methoxyphenyl]-2-methoxybenzamide
CID 26851730
N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
CID 23464385
N-(3-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 43599928
2-chloro-N-[4-[(2,2-diphenylacetyl)carbamothioylamino]-2-methoxyphenyl]benzamide
CID 17317115

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide?
The IUPAC name of 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide (CID 17111377) is 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide.
What is the SMILES notation for 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide?
The canonical SMILES for 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide is COc1cc(NC(=O)c2cc(Cl)ccc2OC)ccc1NC(=O)c1ccccc1Cl.
What is the InChIKey of 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide?
The InChIKey is ITDRPECQPBOOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18Cl2N2O4/c1-29-19-10-7-13(23)11-16(19)22(28)25-14-8-9-18(20(12-14)30-2)26-21(27)15-5-3-4-6-17(15)24/h3-12H,1-2H3,(H,25,28)(H,26,27).
What are the key properties of 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide?
5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide has a molecular weight of 445.30 g/mol, XLogP of 5.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide is sourced from PubChem (CID 17111377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).