4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole

C17H18N4S — CID 110117500

IUPAC4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole
SMILESCc1cnc2n1CC(c1ccccc1)N(Cc1cscn1)C2
InChIInChI=1S/C17H18N4S/c1-13-7-18-17-10-20(8-15-11-22-12-19-15)16(9-21(13)17)14-5-3-2-4-6-14/h2-7,11-12,16H,8-10H2,1H3
InChIKeyZZIPNWUSSUTKSR-UHFFFAOYSA-N
MW310.43 g/mol
LogP3.41
Rot. Bonds3

About 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole

4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole (PubChem CID 110117500) has the molecular formula C17H18N4S and a molecular weight of 310.43 g/mol. Its IUPAC name is 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole.

Molecular Properties

Compound Name4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole
PubChem CID110117500
Molecular FormulaC17H18N4S
Molecular Weight310.43 g/mol
Exact Mass310.13
IUPAC Name4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole
SMILESCc1cnc2n1CC(c1ccccc1)N(Cc1cscn1)C2
InChIInChI=1S/C17H18N4S/c1-13-7-18-17-10-20(8-15-11-22-12-19-15)16(9-21(13)17)14-5-3-2-4-6-14/h2-7,11-12,16H,8-10H2,1H3
InChIKeyZZIPNWUSSUTKSR-UHFFFAOYSA-N
XLogP3.41
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.43
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole with MolForge

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Related Compounds

E6Clv6G2RR
CID 16750138
Imidazopyridine 10e
CID 5329344
Imidazopyridine 10f
CID 5329345
Ikk-IN-3
CID 10215156
12-Methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823959
N,12-dimethyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823960
Dimethyl[2-({12-methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-yl}amino)ethyl]amine
CID 20823982
N-ethyl-12-methyl-4-phenyl-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20824060
Pifithrin-Beta
CID 443278
2-Phenyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole
CID 760886
[4-(2-Methyl-imidazo[1,2-a]pyrimidin-3-yl)-thiazol-2-yl]-p-tolyl-amine
CID 2898055
5,7-dimethyl-2-((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)imidazo[1,2-a]pyrimidine
CID 44548780

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole?
The IUPAC name of 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole (CID 110117500) is 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole.
What is the SMILES notation for 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole?
The canonical SMILES for 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole is Cc1cnc2n1CC(c1ccccc1)N(Cc1cscn1)C2.
What is the InChIKey of 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole?
The InChIKey is ZZIPNWUSSUTKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4S/c1-13-7-18-17-10-20(8-15-11-22-12-19-15)16(9-21(13)17)14-5-3-2-4-6-14/h2-7,11-12,16H,8-10H2,1H3.
What are the key properties of 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole?
4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole has a molecular weight of 310.43 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methyl-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methyl]-1,3-thiazole is sourced from PubChem (CID 110117500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).