(5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one

C23H24FN3O2 — CID 68653142

IUPAC(5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one
SMILESCC[C@]1(c2ccc(C)cc2OC)C(=O)N(Cc2ccc(F)cc2)Cc2cncn21
InChIInChI=1S/C23H24FN3O2/c1-4-23(20-10-5-16(2)11-21(20)29-3)22(28)26(14-19-12-25-15-27(19)23)13-17-6-8-18(24)9-7-17/h5-12,15H,4,13-14H2,1-3H3/t23-/m0/s1
InChIKeyVOGMHYROBPFMJD-QHCPKHFHSA-N
MW393.46 g/mol
LogP4.04
Rot. Bonds5

About (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one

(5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one (PubChem CID 68653142) has the molecular formula C23H24FN3O2 and a molecular weight of 393.46 g/mol. Its IUPAC name is (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one.

Molecular Properties

Compound Name(5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one
PubChem CID68653142
Molecular FormulaC23H24FN3O2
Molecular Weight393.46 g/mol
Exact Mass393.19
IUPAC Name(5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one
SMILESCC[C@]1(c2ccc(C)cc2OC)C(=O)N(Cc2ccc(F)cc2)Cc2cncn21
InChIInChI=1S/C23H24FN3O2/c1-4-23(20-10-5-16(2)11-21(20)29-3)22(28)26(14-19-12-25-15-27(19)23)13-17-6-8-18(24)9-7-17/h5-12,15H,4,13-14H2,1-3H3/t23-/m0/s1
InChIKeyVOGMHYROBPFMJD-QHCPKHFHSA-N
XLogP4.04
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.46
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
The IUPAC name of (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one (CID 68653142) is (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one.
What is the SMILES notation for (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
The canonical SMILES for (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one is CC[C@]1(c2ccc(C)cc2OC)C(=O)N(Cc2ccc(F)cc2)Cc2cncn21.
What is the InChIKey of (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
The InChIKey is VOGMHYROBPFMJD-QHCPKHFHSA-N. The full InChI is InChI=1S/C23H24FN3O2/c1-4-23(20-10-5-16(2)11-21(20)29-3)22(28)26(14-19-12-25-15-27(19)23)13-17-6-8-18(24)9-7-17/h5-12,15H,4,13-14H2,1-3H3/t23-/m0/s1.
What are the key properties of (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one?
(5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one has a molecular weight of 393.46 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-ethyl-7-[(4-fluorophenyl)methyl]-5-(2-methoxy-4-methylphenyl)-8H-imidazo[1,5-a]pyrazin-6-one is sourced from PubChem (CID 68653142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).