N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide

C18H16N4O3S — CID 110664823

IUPACN-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCn1ncc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1-c1ccccc1
InChIInChI=1S/C18H16N4O3S/c1-22-18(12-5-3-2-4-6-12)16(11-19-22)21-26(24,25)14-7-8-15-13(9-14)10-17(23)20-15/h2-9,11,21H,10H2,1H3,(H,20,23)
InChIKeyUTLUDWSELGHKDT-UHFFFAOYSA-N
MW368.42 g/mol
LogP2.38
Rot. Bonds4

About N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide

N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 110664823) has the molecular formula C18H16N4O3S and a molecular weight of 368.42 g/mol. Its IUPAC name is N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID110664823
Molecular FormulaC18H16N4O3S
Molecular Weight368.42 g/mol
Exact Mass368.09
IUPAC NameN-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCn1ncc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1-c1ccccc1
InChIInChI=1S/C18H16N4O3S/c1-22-18(12-5-3-2-4-6-12)16(11-19-22)21-26(24,25)14-7-8-15-13(9-14)10-17(23)20-15/h2-9,11,21H,10H2,1H3,(H,20,23)
InChIKeyUTLUDWSELGHKDT-UHFFFAOYSA-N
XLogP2.38
TPSA93.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.42
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9030807
N-(1-methyl-5-phenylpyrazol-4-yl)-3-nitrobenzenesulfonamide
CID 110664831
2-oxo-N-(4-phenyl-1,3-thiazol-2-yl)-1,3-dihydroindole-5-sulfonamide
CID 9055823
2-oxo-N-pyridin-2-yl-1,3-dihydroindole-5-sulfonamide
CID 110756782
N-(2-chloro-3-pyridinyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 16562517
N-[2-(2-methylphenoxy)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110604721
N-[2-(4-ethylpiperazin-1-yl)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 9030562
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-(3-bromophenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 8015526
N-(3-methylphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 18197715
N-(5-chloropyrazin-2-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 103580637

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 110664823) is N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide is Cn1ncc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1-c1ccccc1.
What is the InChIKey of N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is UTLUDWSELGHKDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O3S/c1-22-18(12-5-3-2-4-6-12)16(11-19-22)21-26(24,25)14-7-8-15-13(9-14)10-17(23)20-15/h2-9,11,21H,10H2,1H3,(H,20,23).
What are the key properties of N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 368.42 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-5-phenylpyrazol-4-yl)-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 110664823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).