7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C16H17N5O2S — CID 97471163

IUPAC7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESO=S(=O)(c1ccccc1)N1CCn2c(Cn3cccn3)cnc2C1
InChIInChI=1S/C16H17N5O2S/c22-24(23,15-5-2-1-3-6-15)20-9-10-21-14(11-17-16(21)13-20)12-19-8-4-7-18-19/h1-8,11H,9-10,12-13H2
InChIKeyURBCDHXJBQBRED-UHFFFAOYSA-N
MW343.41 g/mol
LogP1.33
Rot. Bonds4

About 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 97471163) has the molecular formula C16H17N5O2S and a molecular weight of 343.41 g/mol. Its IUPAC name is 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID97471163
Molecular FormulaC16H17N5O2S
Molecular Weight343.41 g/mol
Exact Mass343.11
IUPAC Name7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESO=S(=O)(c1ccccc1)N1CCn2c(Cn3cccn3)cnc2C1
InChIInChI=1S/C16H17N5O2S/c22-24(23,15-5-2-1-3-6-15)20-9-10-21-14(11-17-16(21)13-20)12-19-8-4-7-18-19/h1-8,11H,9-10,12-13H2
InChIKeyURBCDHXJBQBRED-UHFFFAOYSA-N
XLogP1.33
TPSA73.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.41
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine 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

7-(cyclopropylmethyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97384441
(1-methylpyrrol-2-yl)-[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 97384435
7-[(4-methoxyphenyl)methyl]-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97384428
1,3-bis(benzenesulfonyl)imidazolidine
CID 1354022
2-(4-ethylphenyl)sulfonyl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole
CID 110872466
1-(benzenesulfonyl)-4-[(1-propylimidazol-2-yl)methyl]piperazine
CID 56883312
1-(benzenesulfonyl)-4-[2-(2-ethylimidazol-1-yl)ethyl]piperazine
CID 90561892
7-[4-(2-chloroethyl)phenyl]sulfonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 63021232
2-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]pyrazolo[1,5-a]pyridine
CID 90571604
1-(benzenesulfonyl)-4-(pyridin-3-ylmethyl)piperazine;oxalic acid
CID 90483917
2-[4-(1-benzylpyrazol-4-yl)sulfonylpiperazin-1-yl]-1,3-thiazole
CID 86870379
(6R)-8-(benzenesulfonyl)-6-(methoxymethyl)-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine
CID 97462213

Frequently Asked Questions

What is the IUPAC name of 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 97471163) is 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is O=S(=O)(c1ccccc1)N1CCn2c(Cn3cccn3)cnc2C1.
What is the InChIKey of 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is URBCDHXJBQBRED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2S/c22-24(23,15-5-2-1-3-6-15)20-9-10-21-14(11-17-16(21)13-20)12-19-8-4-7-18-19/h1-8,11H,9-10,12-13H2.
What are the key properties of 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 343.41 g/mol, XLogP of 1.33, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(benzenesulfonyl)-3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 97471163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).