N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide

C21H18N2O4S — CID 110604721

IUPACN-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCc1ccccc1Oc1ccccc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C21H18N2O4S/c1-14-6-2-4-8-19(14)27-20-9-5-3-7-18(20)23-28(25,26)16-10-11-17-15(12-16)13-21(24)22-17/h2-12,23H,13H2,1H3,(H,22,24)
InChIKeyXMXCJTROVZUIAQ-UHFFFAOYSA-N
MW394.45 g/mol
LogP4.08
Rot. Bonds5

About N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide

N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 110604721) has the molecular formula C21H18N2O4S and a molecular weight of 394.45 g/mol. Its IUPAC name is N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID110604721
Molecular FormulaC21H18N2O4S
Molecular Weight394.45 g/mol
Exact Mass394.10
IUPAC NameN-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCc1ccccc1Oc1ccccc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C21H18N2O4S/c1-14-6-2-4-8-19(14)27-20-9-5-3-7-18(20)23-28(25,26)16-10-11-17-15(12-16)13-21(24)22-17/h2-12,23H,13H2,1H3,(H,22,24)
InChIKeyXMXCJTROVZUIAQ-UHFFFAOYSA-N
XLogP4.08
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.45
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-ethoxyphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 18197732
N-(4-fluoro-2-methylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 7667496
N-[4-(2-methylanilino)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 112985929
N-[2-(3-methylphenoxy)phenyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide
CID 25325741
N-[2-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9030807
N-(3-methylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 18197715
N-(2-chloro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 16562517
N-(2-methoxyphenyl)-4,4-dimethyl-2-oxo-1,3-dihydroquinoline-6-sulfonamide
CID 75361116
N-[2-(4-ethylpiperazin-1-yl)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9030562
N-[2-(dimethylamino)-5-fluorophenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 113092568
N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110777264
2-oxo-N-pyridin-2-yl-1,3-dihydroindole-5-sulfonamide
CID 110756782

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 110604721) is N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide is Cc1ccccc1Oc1ccccc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is XMXCJTROVZUIAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O4S/c1-14-6-2-4-8-19(14)27-20-9-5-3-7-18(20)23-28(25,26)16-10-11-17-15(12-16)13-21(24)22-17/h2-12,23H,13H2,1H3,(H,22,24).
What are the key properties of N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 394.45 g/mol, XLogP of 4.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 110604721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).