1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one

C19H15BrClN3O — CID 69362971

IUPAC1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
SMILESO=C1Cn2cnc(-c3cccc(Br)c3)c2CN1Cc1ccc(Cl)cc1
InChIInChI=1S/C19H15BrClN3O/c20-15-3-1-2-14(8-15)19-17-10-23(18(25)11-24(17)12-22-19)9-13-4-6-16(21)7-5-13/h1-8,12H,9-11H2
InChIKeyMRGWPBPTWSWPPS-UHFFFAOYSA-N
MW416.71 g/mol
LogP4.51
Rot. Bonds3

About 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one

1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one (PubChem CID 69362971) has the molecular formula C19H15BrClN3O and a molecular weight of 416.71 g/mol. Its IUPAC name is 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one.

Molecular Properties

Compound Name1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
PubChem CID69362971
Molecular FormulaC19H15BrClN3O
Molecular Weight416.71 g/mol
Exact Mass415.01
IUPAC Name1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
SMILESO=C1Cn2cnc(-c3cccc(Br)c3)c2CN1Cc1ccc(Cl)cc1
InChIInChI=1S/C19H15BrClN3O/c20-15-3-1-2-14(8-15)19-17-10-23(18(25)11-24(17)12-22-19)9-13-4-6-16(21)7-5-13/h1-8,12H,9-11H2
InChIKeyMRGWPBPTWSWPPS-UHFFFAOYSA-N
XLogP4.51
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.71
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
CID 69365583
1-(3-bromophenyl)-7-[(3-fluorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
CID 69362444
1-(3-bromophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine
CID 21203111
1-(3-bromophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine chloride
CID 21203110
1-bromo-3-[4-(4-chlorophenyl)phenyl]benzene
CID 71132921
3-bromo-7-[(4-methoxyphenyl)methyl]-1-phenyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one
CID 69363384
2-(3-bromophenyl)-4-[(4-chlorophenyl)methyl]-4H-imidazole
CID 174448827
3-(3-bromophenyl)-1-[(4-fluorophenyl)methyl]pyrazol-4-amine
CID 83204745
6-bromo-3-[(4-chlorophenyl)methyl]quinazolin-4-one
CID 800705
N-[(3-bromophenyl)methyl]-5-[(4-chlorophenyl)methyl]-4-oxo-7,8-dihydro-6H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
CID 20964817
(5R)-3-(3-bromophenyl)-N-[1-[(4-chlorophenyl)methyl]-5-methylpyrazol-3-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 28873932
5-(3-bromophenyl)-3-butylimidazol-4-amine
CID 62017743

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The IUPAC name of 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one (CID 69362971) is 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one.
What is the SMILES notation for 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The canonical SMILES for 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one is O=C1Cn2cnc(-c3cccc(Br)c3)c2CN1Cc1ccc(Cl)cc1.
What is the InChIKey of 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
The InChIKey is MRGWPBPTWSWPPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrClN3O/c20-15-3-1-2-14(8-15)19-17-10-23(18(25)11-24(17)12-22-19)9-13-4-6-16(21)7-5-13/h1-8,12H,9-11H2.
What are the key properties of 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one?
1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one has a molecular weight of 416.71 g/mol, XLogP of 4.51, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromophenyl)-7-[(4-chlorophenyl)methyl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one is sourced from PubChem (CID 69362971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).