7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine

C13H15N3O3S — CID 56896970

IUPAC7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
SMILESCOc1ccccc1S(=O)(=O)N1CCn2cncc2C1
InChIInChI=1S/C13H15N3O3S/c1-19-12-4-2-3-5-13(12)20(17,18)16-7-6-15-10-14-8-11(15)9-16/h2-5,8,10H,6-7,9H2,1H3
InChIKeyXDQDNTIZSIWZHC-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.10
Rot. Bonds3

About 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine

7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine (PubChem CID 56896970) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
PubChem CID56896970
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
SMILESCOc1ccccc1S(=O)(=O)N1CCn2cncc2C1
InChIInChI=1S/C13H15N3O3S/c1-19-12-4-2-3-5-13(12)20(17,18)16-7-6-15-10-14-8-11(15)9-16/h2-5,8,10H,6-7,9H2,1H3
InChIKeyXDQDNTIZSIWZHC-UHFFFAOYSA-N
XLogP1.10
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3,5-dichloro-4-pyridinyl)-4-(2-methoxyphenyl)sulfonyl-1,4-diazepane
CID 24852724
1-ethylsulfonyl-4-(2-methoxyphenyl)sulfonyl-1,4-diazepane
CID 110799657
1-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]ethanone
CID 47104113
hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride
CID 51066589
1-(4-methoxyphenyl)-4-(2-methoxyphenyl)sulfonylpiperazine
CID 51109656
1-[6-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]pyridazin-3-yl]azepane
CID 122335122
7-(2-methoxyphenyl)sulfonyl-N,N,2-trimethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-amine
CID 56876737
3-imidazol-1-yl-6-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]pyridazine
CID 90539670
3-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]pyridazine
CID 121061006
4-[6-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]pyridazin-3-yl]morpholine
CID 122335405
[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]-(1H-pyrrol-2-yl)methanone
CID 110805410
1-[4-(2-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]pentan-1-one
CID 110797287

Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The IUPAC name of 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine (CID 56896970) is 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine.
What is the SMILES notation for 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The canonical SMILES for 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine is COc1ccccc1S(=O)(=O)N1CCn2cncc2C1.
What is the InChIKey of 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
The InChIKey is XDQDNTIZSIWZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-19-12-4-2-3-5-13(12)20(17,18)16-7-6-15-10-14-8-11(15)9-16/h2-5,8,10H,6-7,9H2,1H3.
What are the key properties of 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine?
7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine has a molecular weight of 293.35 g/mol, XLogP of 1.10, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxyphenyl)sulfonyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine is sourced from PubChem (CID 56896970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).