N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide

C14H12Cl2N2O4S — CID 4793034

IUPACN-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H12Cl2N2O4S/c1-22-13-5-3-9(23(17,20)21)7-10(13)14(19)18-8-2-4-11(15)12(16)6-8/h2-7H,1H3,(H,18,19)(H2,17,20,21)
InChIKeyPNFSNBXFKUVAPT-UHFFFAOYSA-N
MW375.23 g/mol
LogP2.90
Rot. Bonds4

About N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide

N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide (PubChem CID 4793034) has the molecular formula C14H12Cl2N2O4S and a molecular weight of 375.23 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide
PubChem CID4793034
Molecular FormulaC14H12Cl2N2O4S
Molecular Weight375.23 g/mol
Exact Mass373.99
IUPAC NameN-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C14H12Cl2N2O4S/c1-22-13-5-3-9(23(17,20)21)7-10(13)14(19)18-8-2-4-11(15)12(16)6-8/h2-7H,1H3,(H,18,19)(H2,17,20,21)
InChIKeyPNFSNBXFKUVAPT-UHFFFAOYSA-N
XLogP2.90
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.23
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 7479079
N-(4-bromophenyl)-2-methoxy-5-sulfamoylbenzamide
CID 7964867
N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 55348812
2-methoxy-N-(3-methoxyphenyl)-5-sulfamoylbenzamide
CID 27167646
N-(4-ethoxyphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 7779984
N-(3,4-dichlorophenyl)-4-methoxy-3-sulfamoylbenzamide
CID 36859467
ethyl 4-[(2-methoxy-5-sulfamoylbenzoyl)amino]benzoate
CID 4851180
2-chloro-N-(3-chloro-4-fluorophenyl)-5-sulfamoylbenzamide
CID 36704856
propyl 4-[(2-methoxy-5-sulfamoylbenzoyl)amino]benzoate
CID 26864927
N-(3-chloro-4-hydroxyphenyl)-2-methoxy-5-methylbenzamide
CID 63937740
2-chloro-N-(3-chloro-4-methoxyphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26822918
2-methoxy-N-[4-(3-methylphenoxy)phenyl]-5-sulfamoylbenzamide
CID 9453672

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide (CID 4793034) is N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide is COc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide?
The InChIKey is PNFSNBXFKUVAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O4S/c1-22-13-5-3-9(23(17,20)21)7-10(13)14(19)18-8-2-4-11(15)12(16)6-8/h2-7H,1H3,(H,18,19)(H2,17,20,21).
What are the key properties of N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide?
N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide has a molecular weight of 375.23 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-methoxy-5-sulfamoylbenzamide is sourced from PubChem (CID 4793034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).