6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine

C17H19N5O2S — CID 141381347

IUPAC6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine
SMILESCN1CCN(S(=O)(=O)c2ccc(-c3cn4ccnc4cn3)cc2)CC1
InChIInChI=1S/C17H19N5O2S/c1-20-8-10-22(11-9-20)25(23,24)15-4-2-14(3-5-15)16-13-21-7-6-18-17(21)12-19-16/h2-7,12-13H,8-11H2,1H3
InChIKeyCVPPSRWZJZCVJF-UHFFFAOYSA-N
MW357.44 g/mol
LogP1.33
Rot. Bonds3

About 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine

6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine (PubChem CID 141381347) has the molecular formula C17H19N5O2S and a molecular weight of 357.44 g/mol. Its IUPAC name is 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine
PubChem CID141381347
Molecular FormulaC17H19N5O2S
Molecular Weight357.44 g/mol
Exact Mass357.13
IUPAC Name6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine
SMILESCN1CCN(S(=O)(=O)c2ccc(-c3cn4ccnc4cn3)cc2)CC1
InChIInChI=1S/C17H19N5O2S/c1-20-8-10-22(11-9-20)25(23,24)15-4-2-14(3-5-15)16-13-21-7-6-18-17(21)12-19-16/h2-7,12-13H,8-11H2,1H3
InChIKeyCVPPSRWZJZCVJF-UHFFFAOYSA-N
XLogP1.33
TPSA70.81 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.44
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-4-[4-(4-methylphenyl)phenyl]sulfonylpiperazine
CID 889439
1-methyl-4,7,10-tris-(4-methylphenyl)sulfonyl-1,4,7,10-tetrazacyclododecane
CID 12035988
1-methyl-4-(4-methylphenyl)sulfonyl-1,4-diazepane
CID 2354155
1-(4-imidazol-1-ylphenyl)sulfonyl-4-methylpiperazine
CID 14664372
5-(4-methylpiperazin-1-yl)sulfonylpyridine-2-carbaldehyde
CID 135189817
7-imidazo[1,2-a]pyridin-6-yl-2-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]-5-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyrazine
CID 175594909
2-methylpropane;1-methyl-4-(4-propan-2-ylphenyl)sulfonylpiperazine
CID 156878015
tert-butyl 4-[4-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methoxy]phenyl]imidazole-1-carboxylate
CID 167474178
11-methyl-8,14-bis-(4-methylphenyl)sulfonyl-8,11,14,20,21-pentazatricyclo[14.3.1.12,6]henicosa-1(19),2,4,6(21),16(20),17-hexaene
CID 162341949
6-(4-methoxyphenyl)-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]methyl]pyridazin-3-amine
CID 108774984
4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-1-yl)pyrimidine
CID 56921805
3-amino-N-(2-methoxyethyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide
CID 10367481

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine?
The IUPAC name of 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine (CID 141381347) is 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine?
The canonical SMILES for 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine is CN1CCN(S(=O)(=O)c2ccc(-c3cn4ccnc4cn3)cc2)CC1.
What is the InChIKey of 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine?
The InChIKey is CVPPSRWZJZCVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2S/c1-20-8-10-22(11-9-20)25(23,24)15-4-2-14(3-5-15)16-13-21-7-6-18-17(21)12-19-16/h2-7,12-13H,8-11H2,1H3.
What are the key properties of 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine?
6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine has a molecular weight of 357.44 g/mol, XLogP of 1.33, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 141381347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).