1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine

C54H67Cl4N19O8S2 — CID 157322530

IUPAC1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine
SMILESCC(O)C(=O)N1CCN(c2cc(Cl)cc3[nH]nc(N)c23)CC1.CS(=O)(=O)N1CCN(c2cc(Cl)cc3[nH]nc(N)c23)CC1.C[C@@H]1CN(c2cc(Cl)cc3[nH]ncc23)C[C@H](C)N1S(C)(=O)=O.O=C1NC(=O)C2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)N1
InChIInChI=1S/C14H14ClN5O2.C14H18ClN5O2.C14H19ClN4O2S.C12H16ClN5O2S/c15-8-5-10-9(7-16-19-10)11(6-8)20-3-1-14(2-4-20)12(21)17-13(22)18-14;1-8(21)14(22)20-4-2-19(3-5-20)11-7-9(15)6-10-12(11)13(16)18-17-10;1-9-7-18(8-10(2)19(9)22(3,20)21)14-5-11(15)4-13-12(14)6-16-17-13;1-21(19,20)18-4-2-17(3-5-18)10-7-8(13)6-9-11(10)12(14)16-15-9/h5-7H,1-4H2,(H,16,19)(H2,17,18,21,22);6-8,21H,2-5H2,1H3,(H3,16,17,18);4-6,9-10H,7-8H2,1-3H3,(H,16,17);6-7H,2-5H2,1H3,(H3,14,15,16)/t;;9-,10+;
InChIKeyBEIKSENAMYBPFL-BWWQLXOPSA-N
MW1316.20 g/mol
LogP5.18
Rot. Bonds7

About 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine

1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine (PubChem CID 157322530) has the molecular formula C54H67Cl4N19O8S2 and a molecular weight of 1316.20 g/mol. Its IUPAC name is 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine.

Molecular Properties

Compound Name1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine
PubChem CID157322530
Molecular FormulaC54H67Cl4N19O8S2
Molecular Weight1316.20 g/mol
Exact Mass1313.36
IUPAC Name1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine
SMILESCC(O)C(=O)N1CCN(c2cc(Cl)cc3[nH]nc(N)c23)CC1.CS(=O)(=O)N1CCN(c2cc(Cl)cc3[nH]nc(N)c23)CC1.C[C@@H]1CN(c2cc(Cl)cc3[nH]ncc23)C[C@H](C)N1S(C)(=O)=O.O=C1NC(=O)C2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)N1
InChIInChI=1S/C14H14ClN5O2.C14H18ClN5O2.C14H19ClN4O2S.C12H16ClN5O2S/c15-8-5-10-9(7-16-19-10)11(6-8)20-3-1-14(2-4-20)12(21)17-13(22)18-14;1-8(21)14(22)20-4-2-19(3-5-20)11-7-9(15)6-10-12(11)13(16)18-17-10;1-9-7-18(8-10(2)19(9)22(3,20)21)14-5-11(15)4-13-12(14)6-16-17-13;1-21(19,20)18-4-2-17(3-5-18)10-7-8(13)6-9-11(10)12(14)16-15-9/h5-7H,1-4H2,(H,16,19)(H2,17,18,21,22);6-8,21H,2-5H2,1H3,(H3,16,17,18);4-6,9-10H,7-8H2,1-3H3,(H,16,17);6-7H,2-5H2,1H3,(H3,14,15,16)/t;;9-,10+;
InChIKeyBEIKSENAMYBPFL-BWWQLXOPSA-N
XLogP5.18
TPSA353.22 Ų
H-Bond Donors9
H-Bond Acceptors18
Rotatable Bonds7
Heavy Atoms87
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001316.20
LogP ≤ 55.18
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine 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

6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpiperidine-1-carboxamide;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine;1-[2,2-dimethyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperidin-1-yl]ethanone
CID 158943468
2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]-N-methylacetamide;N-[2-[8-(6-chloro-1H-indazol-4-yl)-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl]ethyl]acetamide;methyl 2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]acetate;1-methylsulfonyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]-2,3,4a,5,6,7,8,8a-octahydroquinoxaline
CID 159625005
6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine;1-[2,2-dimethyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]piperidin-1-yl]ethanone
CID 160296578
2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]-N-methylacetamide;N-[2-[8-(6-chloro-1H-indazol-4-yl)-2,4-dioxo-1,3,8-triazaspiro[4.5]decan-3-yl]ethyl]methanesulfonamide;methyl 2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]acetate;1-methylsulfonyl-4-[6-(trifluoromethyl)-1H-indazol-4-yl]-2,3,4a,5,6,7,8,8a-octahydroquinoxaline
CID 161619835
6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole;1-[4-(1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]ethanone;1-[4-(1H-indazol-4-yl)-2-methylpiperazin-1-yl]ethanone;4-(3-methyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole
CID 157092304
1-(6-chloro-1H-indazol-4-yl)-N,4-dimethylpiperidine-4-carboxamide;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decan-4-one;N-[2-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]ethyl]acetamide;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazole-7-carbonitrile
CID 157218185
6-chloro-4-(1-cyclopentylsulfonylpiperidin-4-yl)-1H-indazole;2-[(6-chloro-1H-indazol-4-yl)amino]ethanol;8-(6-chloro-1H-indazol-4-yl)-3-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(1-propan-2-ylsulfonylpiperidin-4-yl)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-propan-2-yl-1H-indazole
CID 157306803
N-[2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]ethyl]acetamide;N-[2-[4-(6-chloro-1H-indazol-4-yl)-2,2-dimethylpiperazin-1-yl]ethyl]methanesulfonamide;8-(6-chloro-1H-indazol-4-yl)-3-phenyl-1,3,8-triazaspiro[4.5]decan-4-one;6-(6-chloro-1H-indazol-4-yl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine;cis-(1R,2R)-2-(6-chloro-1H-indazol-4-yl)cyclohexan-1-ol;trans-(1S,2R)-2-(6-chloro-1H-indazol-4-yl)cyclohexan-1-ol
CID 157323482
6-chloro-4-(1-cyclopentylsulfonylpiperidin-4-yl)-1H-indazole;2-[(6-chloro-1H-indazol-4-yl)amino]ethanol;8-(6-chloro-1H-indazol-4-yl)-3-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-propan-2-yl-1H-indazole
CID 157496943
6-chloro-4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1-methylindazole;4-(6-chloro-1H-indazol-4-yl)piperazine-1-carboxamide;[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-cyclopropylmethanone;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-methylpropan-1-one;1-[4-(6-chloro-1H-indazol-4-yl)piperazin-1-yl]propan-1-one
CID 157541172
3-benzyl-8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-(2-hydroxyethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;8-(6-chloro-1H-indazol-4-yl)-3-(2-methoxyethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 157594219
1-[8-(6-chloro-1H-indazol-4-yl)-5,8-diazaspiro[3.5]nonan-5-yl]ethanone;8-(6-chloro-1H-indazol-4-yl)-1-methyl-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(5-methylsulfonyl-5,8-diazaspiro[3.5]nonan-8-yl)-1H-indazole;6-chloro-4-(4-phenylpiperidin-1-yl)-1H-indazole;4-[4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-1H-indazol-6-yl]morpholine
CID 157792582

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine?
The IUPAC name of 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine (CID 157322530) is 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine.
What is the SMILES notation for 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine?
The canonical SMILES for 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine is CC(O)C(=O)N1CCN(c2cc(Cl)cc3[nH]nc(N)c23)CC1.CS(=O)(=O)N1CCN(c2cc(Cl)cc3[nH]nc(N)c23)CC1.C[C@@H]1CN(c2cc(Cl)cc3[nH]ncc23)C[C@H](C)N1S(C)(=O)=O.O=C1NC(=O)C2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)N1.
What is the InChIKey of 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine?
The InChIKey is BEIKSENAMYBPFL-BWWQLXOPSA-N. The full InChI is InChI=1S/C14H14ClN5O2.C14H18ClN5O2.C14H19ClN4O2S.C12H16ClN5O2S/c15-8-5-10-9(7-16-19-10)11(6-8)20-3-1-14(2-4-20)12(21)17-13(22)18-14;1-8(21)14(22)20-4-2-19(3-5-20)11-7-9(15)6-10-12(11)13(16)18-17-10;1-9-7-18(8-10(2)19(9)22(3,20)21)14-5-11(15)4-13-12(14)6-16-17-13;1-21(19,20)18-4-2-17(3-5-18)10-7-8(13)6-9-11(10)12(14)16-15-9/h5-7H,1-4H2,(H,16,19)(H2,17,18,21,22);6-8,21H,2-5H2,1H3,(H3,16,17,18);4-6,9-10H,7-8H2,1-3H3,(H,16,17);6-7H,2-5H2,1H3,(H3,14,15,16)/t;;9-,10+;.
What are the key properties of 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine?
1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine has a molecular weight of 1316.20 g/mol, XLogP of 5.18, 7 rotatable bonds, 9 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-amino-6-chloro-1H-indazol-4-yl)piperazin-1-yl]-2-hydroxypropan-1-one;6-chloro-4-[(3R,5S)-3,5-dimethyl-4-methylsulfonylpiperazin-1-yl]-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione;6-chloro-4-(4-methylsulfonylpiperazin-1-yl)-1H-indazol-3-amine is sourced from PubChem (CID 157322530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).