N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide

C24H24F2N2O5S — CID 41262425

IUPACN-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide
SMILESCOc1cc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(C)c(C)c3)cc2)ccc1OC(F)F
InChIInChI=1S/C24H24F2N2O5S/c1-15-4-8-19(12-16(15)2)28-34(30,31)20-9-6-18(7-10-20)23(29)27-14-17-5-11-21(33-24(25)26)22(13-17)32-3/h4-13,24,28H,14H2,1-3H3,(H,27,29)
InChIKeyDPAJPZOFUOJEDL-UHFFFAOYSA-N
MW490.53 g/mol
LogP4.64
Rot. Bonds9

About N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide

N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide (PubChem CID 41262425) has the molecular formula C24H24F2N2O5S and a molecular weight of 490.53 g/mol. Its IUPAC name is N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide
PubChem CID41262425
Molecular FormulaC24H24F2N2O5S
Molecular Weight490.53 g/mol
Exact Mass490.14
IUPAC NameN-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide
SMILESCOc1cc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(C)c(C)c3)cc2)ccc1OC(F)F
InChIInChI=1S/C24H24F2N2O5S/c1-15-4-8-19(12-16(15)2)28-34(30,31)20-9-6-18(7-10-20)23(29)27-14-17-5-11-21(33-24(25)26)22(13-17)32-3/h4-13,24,28H,14H2,1-3H3,(H,27,29)
InChIKeyDPAJPZOFUOJEDL-UHFFFAOYSA-N
XLogP4.64
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.53
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide with MolForge

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Related Compounds

N-[(3,4-dimethoxyphenyl)methyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 46771161
N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-2-methyl-5-[(4-methylphenyl)sulfamoyl]benzamide
CID 38966384
4-[(3,4-dimethylphenyl)sulfamoyl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 26775951
N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-(difluoromethylsulfanyl)benzamide
CID 42119354
4-(difluoromethoxy)-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-3-ethoxybenzamide
CID 9261772
N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-3-(dimethylsulfamoyl)-4-methoxybenzamide
CID 46420991
4-[(4-ethoxyphenyl)sulfamoyl]-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide
CID 55678008
4-(difluoromethoxy)-N-[2-[[4-(difluoromethoxy)-3-methoxyphenyl]methylamino]-2-oxoethyl]-3-methoxybenzamide
CID 31553535
N-[2-[[4-(difluoromethoxy)-3-methoxyphenyl]methylamino]-2-oxoethyl]-4-fluorobenzamide
CID 17480128
N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]-3-methoxy-4-methylbenzamide
CID 8528927
N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]-4-(methoxymethyl)benzamide
CID 9482427
4-acetyl-N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]benzenesulfonamide
CID 8817900

Frequently Asked Questions

What is the IUPAC name of N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide (CID 41262425) is N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide is COc1cc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(C)c(C)c3)cc2)ccc1OC(F)F.
What is the InChIKey of N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
The InChIKey is DPAJPZOFUOJEDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24F2N2O5S/c1-15-4-8-19(12-16(15)2)28-34(30,31)20-9-6-18(7-10-20)23(29)27-14-17-5-11-21(33-24(25)26)22(13-17)32-3/h4-13,24,28H,14H2,1-3H3,(H,27,29).
What are the key properties of N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide?
N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide has a molecular weight of 490.53 g/mol, XLogP of 4.64, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-4-[(3,4-dimethylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 41262425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).