N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide

C19H18N4O5S — CID 18775433

IUPACN-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
SMILESCOc1ccccc1NS(=O)(=O)c1cccc(NC(=O)c2ccc(=O)n(C)n2)c1
InChIInChI=1S/C19H18N4O5S/c1-23-18(24)11-10-16(21-23)19(25)20-13-6-5-7-14(12-13)29(26,27)22-15-8-3-4-9-17(15)28-2/h3-12,22H,1-2H3,(H,20,25)
InChIKeySHIWPMNPNNQMGT-UHFFFAOYSA-N
MW414.44 g/mol
LogP1.84
Rot. Bonds6

About N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide

N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide (PubChem CID 18775433) has the molecular formula C19H18N4O5S and a molecular weight of 414.44 g/mol. Its IUPAC name is N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
PubChem CID18775433
Molecular FormulaC19H18N4O5S
Molecular Weight414.44 g/mol
Exact Mass414.10
IUPAC NameN-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
SMILESCOc1ccccc1NS(=O)(=O)c1cccc(NC(=O)c2ccc(=O)n(C)n2)c1
InChIInChI=1S/C19H18N4O5S/c1-23-18(24)11-10-16(21-23)19(25)20-13-6-5-7-14(12-13)29(26,27)22-15-8-3-4-9-17(15)28-2/h3-12,22H,1-2H3,(H,20,25)
InChIKeySHIWPMNPNNQMGT-UHFFFAOYSA-N
XLogP1.84
TPSA119.39 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.44
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-methoxy-N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 39977662
1-benzyl-N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-3,5-dimethylpyrazole-4-carboxamide
CID 4878197
N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 24513677
N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]cyclopentanecarboxamide
CID 9414168
1-methyl-N-[2-methyl-5-[(3-methylphenyl)sulfamoyl]phenyl]-6-oxopyridazine-3-carboxamide
CID 8015664
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
N-(3-cyanophenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 9164272
4-[(2-methoxyphenyl)sulfamoyl]-N-(3-methylphenyl)benzamide
CID 26538003
3-[[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]benzoic acid
CID 1356397
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 55349074
3-[[4-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide
CID 30379129
N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanamide
CID 24531599

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide?
The IUPAC name of N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide (CID 18775433) is N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide.
What is the SMILES notation for N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide?
The canonical SMILES for N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide is COc1ccccc1NS(=O)(=O)c1cccc(NC(=O)c2ccc(=O)n(C)n2)c1.
What is the InChIKey of N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide?
The InChIKey is SHIWPMNPNNQMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O5S/c1-23-18(24)11-10-16(21-23)19(25)20-13-6-5-7-14(12-13)29(26,27)22-15-8-3-4-9-17(15)28-2/h3-12,22H,1-2H3,(H,20,25).
What are the key properties of N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide?
N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide has a molecular weight of 414.44 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide is sourced from PubChem (CID 18775433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).