N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide

C15H14Cl2N2O4S — CID 4794585

IUPACN-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H14Cl2N2O4S/c1-23-14-5-4-11(24(18,21)22)7-12(14)15(20)19-8-9-2-3-10(16)6-13(9)17/h2-7H,8H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyKMOPDSNPVSNZNJ-UHFFFAOYSA-N
MW389.26 g/mol
LogP2.58
Rot. Bonds5

About N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide

N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide (PubChem CID 4794585) has the molecular formula C15H14Cl2N2O4S and a molecular weight of 389.26 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide
PubChem CID4794585
Molecular FormulaC15H14Cl2N2O4S
Molecular Weight389.26 g/mol
Exact Mass388.01
IUPAC NameN-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H14Cl2N2O4S/c1-23-14-5-4-11(24(18,21)22)7-12(14)15(20)19-8-9-2-3-10(16)6-13(9)17/h2-7H,8H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyKMOPDSNPVSNZNJ-UHFFFAOYSA-N
XLogP2.58
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.26
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-methylbenzamide
CID 9268844
N-ethyl-2-methoxy-5-sulfamoylbenzamide
CID 6473438
N-[(2,4-dichlorophenyl)methyl]-2,3,4-trimethoxybenzamide
CID 55329564
N-benzyl-2-methoxy-5-sulfamoylbenzamide
CID 827282
N-[(2-bromo-5-fluorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide
CID 55947717
N-[(5-amino-2-hydroxyphenyl)methyl]-5-chloro-2-methoxybenzamide
CID 43548657
[2-[2-(5-chloro-2-methoxybenzoyl)hydrazinyl]-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate
CID 16518351
[2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate
CID 7468025
2-methoxy-N-[(3-methoxyphenyl)methyl]-5-sulfamoylbenzamide
CID 9495729
N-butyl-2-methoxy-5-sulfamoylbenzamide
CID 31321939
N-[(2,4-dichlorophenyl)methyl]-4,5-dimethoxy-2-[methyl(methylsulfonyl)amino]benzamide
CID 30148202
[2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] 5-chloro-2-methoxybenzoate
CID 2614690

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide (CID 4794585) is N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide is COc1ccc(S(N)(=O)=O)cc1C(=O)NCc1ccc(Cl)cc1Cl.
What is the InChIKey of N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide?
The InChIKey is KMOPDSNPVSNZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O4S/c1-23-14-5-4-11(24(18,21)22)7-12(14)15(20)19-8-9-2-3-10(16)6-13(9)17/h2-7H,8H2,1H3,(H,19,20)(H2,18,21,22).
What are the key properties of N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide?
N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide has a molecular weight of 389.26 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methyl]-2-methoxy-5-sulfamoylbenzamide is sourced from PubChem (CID 4794585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).