6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole

C24H18N8S2 — CID 70696874

IUPAC6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole
SMILESc1cc2nc(-c3cnc(-c4nc5ccc(C6=NCCN6)cc5s4)cn3)sc2cc1C1=NCCN1
InChIInChI=1S/C24H18N8S2/c1-3-15-19(9-13(1)21-25-5-6-26-21)33-23(31-15)17-11-30-18(12-29-17)24-32-16-4-2-14(10-20(16)34-24)22-27-7-8-28-22/h1-4,9-12H,5-8H2,(H,25,26)(H,27,28)
InChIKeyHYJFOPDNBHYELW-UHFFFAOYSA-N
MW482.60 g/mol
LogP3.73
Rot. Bonds4

About 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole

6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole (PubChem CID 70696874) has the molecular formula C24H18N8S2 and a molecular weight of 482.60 g/mol. Its IUPAC name is 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole.

Molecular Properties

Compound Name6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole
PubChem CID70696874
Molecular FormulaC24H18N8S2
Molecular Weight482.60 g/mol
Exact Mass482.11
IUPAC Name6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole
SMILESc1cc2nc(-c3cnc(-c4nc5ccc(C6=NCCN6)cc5s4)cn3)sc2cc1C1=NCCN1
InChIInChI=1S/C24H18N8S2/c1-3-15-19(9-13(1)21-25-5-6-26-21)33-23(31-15)17-11-30-18(12-29-17)24-32-16-4-2-14(10-20(16)34-24)22-27-7-8-28-22/h1-4,9-12H,5-8H2,(H,25,26)(H,27,28)
InChIKeyHYJFOPDNBHYELW-UHFFFAOYSA-N
XLogP3.73
TPSA100.34 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.60
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole with MolForge

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Related Compounds

4-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]aniline;hydrate;hydrochloride
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2-naphthalen-2-yl-4,5-dihydro-1H-imidazole
CID 11769428
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CID 3410883
2-thianthren-2-yl-4,5-dihydro-1H-imidazole
CID 10779436
2-[4-[3-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phenyl]phenyl]-4,5-dihydro-1H-imidazole
CID 71747659
2-[3-[2-amino-4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]propoxy]-5-(4,5-dihydro-1H-imidazol-2-yl)aniline
CID 44573802
6-bromo-2-(2,3-dihydro-1H-indol-5-yl)-1,3-benzothiazole
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4-(4,5-dihydro-1H-imidazol-2-yl)aniline;dihydrochloride
CID 131857120
2-(4-naphthalen-2-ylphenyl)-4,5-dihydro-1H-imidazole;hydroiodide
CID 158320426
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CID 16659036

Frequently Asked Questions

What is the IUPAC name of 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole?
The IUPAC name of 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole (CID 70696874) is 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole.
What is the SMILES notation for 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole?
The canonical SMILES for 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole is c1cc2nc(-c3cnc(-c4nc5ccc(C6=NCCN6)cc5s4)cn3)sc2cc1C1=NCCN1.
What is the InChIKey of 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole?
The InChIKey is HYJFOPDNBHYELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N8S2/c1-3-15-19(9-13(1)21-25-5-6-26-21)33-23(31-15)17-11-30-18(12-29-17)24-32-16-4-2-14(10-20(16)34-24)22-27-7-8-28-22/h1-4,9-12H,5-8H2,(H,25,26)(H,27,28).
What are the key properties of 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole?
6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole has a molecular weight of 482.60 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[6-(4,5-dihydro-1H-imidazol-2-yl)-1,3-benzothiazol-2-yl]pyrazin-2-yl]-1,3-benzothiazole is sourced from PubChem (CID 70696874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).