N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

C18H18N6O2S — CID 118721252

IUPACN-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-c2ccc3c(N)n[nH]c3c2)cc1
InChIInChI=1S/C18H18N6O2S/c1-10-17(11(2)21-20-10)27(25,26)24-14-6-3-12(4-7-14)13-5-8-15-16(9-13)22-23-18(15)19/h3-9,24H,1-2H3,(H,20,21)(H3,19,22,23)
InChIKeyTVMSGMTURGENQY-UHFFFAOYSA-N
MW382.45 g/mol
LogP2.95
Rot. Bonds4

About N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide

N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide (PubChem CID 118721252) has the molecular formula C18H18N6O2S and a molecular weight of 382.45 g/mol. Its IUPAC name is N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
PubChem CID118721252
Molecular FormulaC18H18N6O2S
Molecular Weight382.45 g/mol
Exact Mass382.12
IUPAC NameN-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-c2ccc3c(N)n[nH]c3c2)cc1
InChIInChI=1S/C18H18N6O2S/c1-10-17(11(2)21-20-10)27(25,26)24-14-6-3-12(4-7-14)13-5-8-15-16(9-13)22-23-18(15)19/h3-9,24H,1-2H3,(H,20,21)(H3,19,22,23)
InChIKeyTVMSGMTURGENQY-UHFFFAOYSA-N
XLogP2.95
TPSA129.55 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.45
LogP ≤ 52.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-amino-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide
CID 24963047
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-5-chloro-2-fluorobenzenesulfonamide
CID 118721271
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2,5-dichlorothiophene-3-sulfonamide
CID 118721256
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2-chlorobenzenesulfonamide
CID 118721258
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2,5-dichlorobenzenesulfonamide
CID 118721259
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2-fluoro-5-(trifluoromethyl)benzenesulfonamide
CID 118721263
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2-fluorobenzenesulfonamide
CID 118721264
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-2,5-difluorobenzenesulfonamide
CID 118721266
3-(3-amino-1H-indazol-5-yl)-2-(1H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide
CID 118266474
3-(3-amino-1H-indazol-6-yl)-2-(1H-tetrazol-5-yl)-6-(trifluoromethyl)benzenesulfonamide
CID 118266588
4-(3-amino-7-methyl-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide
CID 44570477
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-1-phenylmethanesulfonamide
CID 118721250

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide (CID 118721252) is N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-c2ccc3c(N)n[nH]c3c2)cc1.
What is the InChIKey of N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is TVMSGMTURGENQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O2S/c1-10-17(11(2)21-20-10)27(25,26)24-14-6-3-12(4-7-14)13-5-8-15-16(9-13)22-23-18(15)19/h3-9,24H,1-2H3,(H,20,21)(H3,19,22,23).
What are the key properties of N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 382.45 g/mol, XLogP of 2.95, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-amino-1H-indazol-6-yl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 118721252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).