N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide

C11H9N5O4S — CID 21008102

IUPACN-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
SMILESO=c1[nH]cc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)c(=O)[nH]1
InChIInChI=1S/C11H9N5O4S/c17-10-9(5-12-11(18)14-10)21(19,20)16-7-2-1-6-4-13-15-8(6)3-7/h1-5,16H,(H,13,15)(H2,12,14,17,18)
InChIKeyPVSKTYQNLIVZID-UHFFFAOYSA-N
MW307.29 g/mol
LogP-0.26
Rot. Bonds3

About N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide

N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide (PubChem CID 21008102) has the molecular formula C11H9N5O4S and a molecular weight of 307.29 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
PubChem CID21008102
Molecular FormulaC11H9N5O4S
Molecular Weight307.29 g/mol
Exact Mass307.04
IUPAC NameN-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
SMILESO=c1[nH]cc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)c(=O)[nH]1
InChIInChI=1S/C11H9N5O4S/c17-10-9(5-12-11(18)14-10)21(19,20)16-7-2-1-6-4-13-15-8(6)3-7/h1-5,16H,(H,13,15)(H2,12,14,17,18)
InChIKeyPVSKTYQNLIVZID-UHFFFAOYSA-N
XLogP-0.26
TPSA140.57 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.29
LogP ≤ 5-0.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1H-indazol-6-yl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 61276176
N-(3,4-difluorophenyl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 7244628
2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide
CID 2445035
N-(4-fluorophenyl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 7244632
N-(1H-indazol-6-yl)-2,4-dimethylbenzenesulfonamide
CID 2078539
N-(4-methylphenyl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 7161234
N-(1H-indazol-6-yl)sulfamoyl chloride
CID 84760699
N-(3-chloro-4-methylphenyl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 7253860
N-(1H-indazol-6-yl)-2-(trifluoromethyl)benzenesulfonamide
CID 2445030
N-(1H-indazol-6-yl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 110731214
5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
CID 2444866
2,4-dioxo-N-(4-sulfamoylphenyl)-1H-pyrimidine-5-sulfonamide
CID 43980578

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide?
The IUPAC name of N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide (CID 21008102) is N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide?
The canonical SMILES for N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide is O=c1[nH]cc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)c(=O)[nH]1.
What is the InChIKey of N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide?
The InChIKey is PVSKTYQNLIVZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O4S/c17-10-9(5-12-11(18)14-10)21(19,20)16-7-2-1-6-4-13-15-8(6)3-7/h1-5,16H,(H,13,15)(H2,12,14,17,18).
What are the key properties of N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide?
N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide has a molecular weight of 307.29 g/mol, XLogP of -0.26, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide is sourced from PubChem (CID 21008102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).