N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide

C24H25N5O4S — CID 24981167

IUPACN-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide
SMILESCN(C)C(CNC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1)c1ccccc1
InChIInChI=1S/C24H25N5O4S/c1-29(2)22(16-6-4-3-5-7-16)15-25-23(30)17-8-10-18(11-9-17)28-34(32,33)19-12-13-20-21(14-19)27-24(31)26-20/h3-14,22,28H,15H2,1-2H3,(H,25,30)(H2,26,27,31)
InChIKeyWFRDPVULDZOQDH-UHFFFAOYSA-N
MW479.56 g/mol
LogP2.69
Rot. Bonds8

About N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide

N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide (PubChem CID 24981167) has the molecular formula C24H25N5O4S and a molecular weight of 479.56 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide
PubChem CID24981167
Molecular FormulaC24H25N5O4S
Molecular Weight479.56 g/mol
Exact Mass479.16
IUPAC NameN-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide
SMILESCN(C)C(CNC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1)c1ccccc1
InChIInChI=1S/C24H25N5O4S/c1-29(2)22(16-6-4-3-5-7-16)15-25-23(30)17-8-10-18(11-9-17)28-34(32,33)19-12-13-20-21(14-19)27-24(31)26-20/h3-14,22,28H,15H2,1-2H3,(H,25,30)(H2,26,27,31)
InChIKeyWFRDPVULDZOQDH-UHFFFAOYSA-N
XLogP2.69
TPSA127.16 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.56
LogP ≤ 52.69
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide with MolForge

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Related Compounds

N-[3-(dimethylsulfamoyl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 4875218
N-ethyl-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide
CID 24670610
DW-2282 free base
CID 9870546
DW-2143 free base
CID 9935663
4-phenyl-1-(N-benzoylindoline-5-sulfonyl)-4,5-dihydro-2-imidazolone
CID 21224938
4-Amino-N-[2-chloro-4-((S)-2-oxo-4-phenyl-imidazolidine-1-sulfonyl)-phenyl]-benzamide
CID 44397049
N-hydroxy-4-[[1,1,3-trioxo-6-[(2-phenylacetyl)amino]-1,2-benzothiazol-2-yl]methyl]benzamide
CID 122186724
1-(4-Acetylphenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)urea
CID 2209389
N-[4-[2-(diethylamino)ethylcarbamoyl]phenyl]-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
CID 2511795
3-(2,3-dihydroindol-1-ylsulfonyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 4855702
N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-4-[methyl(methylsulfonyl)amino]benzamide
CID 6461555
4-(Allyl-methanesulfonyl-amino)-N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzoimidazol-5-yl)-benzamide
CID 6492933

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide?
The IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide (CID 24981167) is N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide is CN(C)C(CNC(=O)c1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1)c1ccccc1.
What is the InChIKey of N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide?
The InChIKey is WFRDPVULDZOQDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O4S/c1-29(2)22(16-6-4-3-5-7-16)15-25-23(30)17-8-10-18(11-9-17)28-34(32,33)19-12-13-20-21(14-19)27-24(31)26-20/h3-14,22,28H,15H2,1-2H3,(H,25,30)(H2,26,27,31).
What are the key properties of N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide?
N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide has a molecular weight of 479.56 g/mol, XLogP of 2.69, 8 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-phenylethyl]-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide is sourced from PubChem (CID 24981167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).