2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine

C25H16Cl3N3 — CID 24995726

IUPAC2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine
SMILESCc1nc(-c2ccccc2)cn2c(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)nc12
InChIInChI=1S/C25H16Cl3N3/c1-15-25-30-23(17-7-9-18(26)10-8-17)24(20-12-11-19(27)13-21(20)28)31(25)14-22(29-15)16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyDYOJHGNDPKHDQQ-UHFFFAOYSA-N
MW464.78 g/mol
LogP8.00
Rot. Bonds3

About 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine

2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine (PubChem CID 24995726) has the molecular formula C25H16Cl3N3 and a molecular weight of 464.78 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine
PubChem CID24995726
Molecular FormulaC25H16Cl3N3
Molecular Weight464.78 g/mol
Exact Mass463.04
IUPAC Name2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine
SMILESCc1nc(-c2ccccc2)cn2c(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)nc12
InChIInChI=1S/C25H16Cl3N3/c1-15-25-30-23(17-7-9-18(26)10-8-17)24(20-12-11-19(27)13-21(20)28)31(25)14-22(29-15)16-5-3-2-4-6-16/h2-14H,1H3
InChIKeyDYOJHGNDPKHDQQ-UHFFFAOYSA-N
XLogP8.00
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.78
LogP ≤ 58.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine?
The IUPAC name of 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine (CID 24995726) is 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine?
The canonical SMILES for 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine is Cc1nc(-c2ccccc2)cn2c(-c3ccc(Cl)cc3Cl)c(-c3ccc(Cl)cc3)nc12.
What is the InChIKey of 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine?
The InChIKey is DYOJHGNDPKHDQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16Cl3N3/c1-15-25-30-23(17-7-9-18(26)10-8-17)24(20-12-11-19(27)13-21(20)28)31(25)14-22(29-15)16-5-3-2-4-6-16/h2-14H,1H3.
What are the key properties of 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine?
2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine has a molecular weight of 464.78 g/mol, XLogP of 8.00, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-8-methyl-6-phenylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 24995726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).