[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane

C30H32Br2N8O2Si — CID 161262421

IUPAC[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1cncc(-n2ncc3ccc(Br)cc32)n1.OCc1cncc(-n2ncc3ccc(Br)cc32)n1
InChIInChI=1S/C18H23BrN4OSi.C12H9BrN4O/c1-18(2,3)25(4,5)24-12-15-10-20-11-17(22-15)23-16-8-14(19)7-6-13(16)9-21-23;13-9-2-1-8-4-15-17(11(8)3-9)12-6-14-5-10(7-18)16-12/h6-11H,12H2,1-5H3;1-6,18H,7H2
InChIKeyVCSRCBADLJSNTG-UHFFFAOYSA-N
MW724.53 g/mol
LogP7.17
Rot. Bonds6

About [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane

[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane (PubChem CID 161262421) has the molecular formula C30H32Br2N8O2Si and a molecular weight of 724.53 g/mol. Its IUPAC name is [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane.

Molecular Properties

Compound Name[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane
PubChem CID161262421
Molecular FormulaC30H32Br2N8O2Si
Molecular Weight724.53 g/mol
Exact Mass722.08
IUPAC Name[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1cncc(-n2ncc3ccc(Br)cc32)n1.OCc1cncc(-n2ncc3ccc(Br)cc32)n1
InChIInChI=1S/C18H23BrN4OSi.C12H9BrN4O/c1-18(2,3)25(4,5)24-12-15-10-20-11-17(22-15)23-16-8-14(19)7-6-13(16)9-21-23;13-9-2-1-8-4-15-17(11(8)3-9)12-6-14-5-10(7-18)16-12/h6-11H,12H2,1-5H3;1-6,18H,7H2
InChIKeyVCSRCBADLJSNTG-UHFFFAOYSA-N
XLogP7.17
TPSA116.66 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500724.53
LogP ≤ 57.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane 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-[6-bromo-4-(2-methoxyethoxy)indazol-1-yl]pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane
CID 140798244
[6-[6-[6-[(1S)-1-aminoethyl]-2-pyridinyl]indazol-1-yl]pyrazin-2-yl]methanol
CID 118664225
[6-[6-[6-(4-aminobutyl)-2-pyridinyl]indazol-1-yl]pyrazin-2-yl]methanol
CID 155123770
[6-(6-bromoindazol-2-yl)-2-pyridinyl]methoxy-tert-butyl-dimethylsilane
CID 140798469
1-[6-bromo-1-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]indazol-4-yl]oxy-2-methylpropan-2-ol;1-[6-bromo-1-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]indazol-4-yl]oxypropan-2-one
CID 159928020
[6-(6-bromoindazol-1-yl)-2-pyridinyl]methanol;6-bromo-1H-isoindole;(6-bromo-2-pyridinyl)methanol
CID 157302656
2-[5-bromo-2-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanol
CID 10641233
2-[1-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]indazol-6-yl]-N-methoxy-N-methylpyrimidine-4-carboxamide
CID 140798341
6-(6-bromoindazol-1-yl)pyridine-2-carbonitrile
CID 118664660
(4-bromophenyl)methoxy-tert-butyl-dimethylsilane
CID 10859583
1-(3-bromophenyl)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrazol-5-amine
CID 176757799
1-[6-bromo-1-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]indazol-4-yl]oxy-2-methylpropan-2-ol;1-[1-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-4-yl]oxy-2-methylpropan-2-ol;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
CID 157392172

Frequently Asked Questions

What is the IUPAC name of [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane?
The IUPAC name of [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane (CID 161262421) is [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane?
The canonical SMILES for [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1cncc(-n2ncc3ccc(Br)cc32)n1.OCc1cncc(-n2ncc3ccc(Br)cc32)n1.
What is the InChIKey of [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane?
The InChIKey is VCSRCBADLJSNTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23BrN4OSi.C12H9BrN4O/c1-18(2,3)25(4,5)24-12-15-10-20-11-17(22-15)23-16-8-14(19)7-6-13(16)9-21-23;13-9-2-1-8-4-15-17(11(8)3-9)12-6-14-5-10(7-18)16-12/h6-11H,12H2,1-5H3;1-6,18H,7H2.
What are the key properties of [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane?
[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane has a molecular weight of 724.53 g/mol, XLogP of 7.17, 6 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(6-bromoindazol-1-yl)pyrazin-2-yl]methanol;[6-(6-bromoindazol-1-yl)pyrazin-2-yl]methoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 161262421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).