5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine

C122H99Cl5N24S5 — CID 158149592

IUPAC5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine
SMILESCCN(CC)CSc1nc(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc1N.CN1CCC(Sc2nc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2N)CC1.Cn1ccc(Sc2nc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2N)c1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)nc1Sc1ccccc1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)nc1Sc1cccnc1
InChIInChI=1S/C25H24ClN5S.C25H17ClN4S.C24H18ClN5S.C24H16ClN5S.C24H24ClN5S/c1-31-12-9-19(10-13-31)32-25-24(27)29-22(16-6-3-2-4-7-16)23(30-25)18-14-17-8-5-11-28-21(17)20(26)15-18;26-20-15-18(14-17-10-7-13-28-21(17)20)23-22(16-8-3-1-4-9-16)29-24(27)25(30-23)31-19-11-5-2-6-12-19;1-30-11-9-18(14-30)31-24-23(26)28-21(15-6-3-2-4-7-15)22(29-24)17-12-16-8-5-10-27-20(16)19(25)13-17;25-19-13-17(12-16-8-4-11-28-20(16)19)22-21(15-6-2-1-3-7-15)29-23(26)24(30-22)31-18-9-5-10-27-14-18;1-3-30(4-2)15-31-24-23(26)28-21(16-9-6-5-7-10-16)22(29-24)18-13-17-11-8-12-27-20(17)19(25)14-18/h2-8,11,14-15,19H,9-10,12-13H2,1H3,(H2,27,29);1-15H,(H2,27,29);2-14H,1H3,(H2,26,28);1-14H,(H2,26,29);5-14H,3-4,15H2,1-2H3,(H2,26,28)
InChIKeyFUYADPUYVGSDJF-UHFFFAOYSA-N
MW2238.90 g/mol
LogP30.74
Rot. Bonds23

About 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine

5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine (PubChem CID 158149592) has the molecular formula C122H99Cl5N24S5 and a molecular weight of 2238.90 g/mol. Its IUPAC name is 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine.

Molecular Properties

Compound Name5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine
PubChem CID158149592
Molecular FormulaC122H99Cl5N24S5
Molecular Weight2238.90 g/mol
Exact Mass2234.55
IUPAC Name5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine
SMILESCCN(CC)CSc1nc(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc1N.CN1CCC(Sc2nc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2N)CC1.Cn1ccc(Sc2nc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2N)c1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)nc1Sc1ccccc1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)nc1Sc1cccnc1
InChIInChI=1S/C25H24ClN5S.C25H17ClN4S.C24H18ClN5S.C24H16ClN5S.C24H24ClN5S/c1-31-12-9-19(10-13-31)32-25-24(27)29-22(16-6-3-2-4-7-16)23(30-25)18-14-17-8-5-11-28-21(17)20(26)15-18;26-20-15-18(14-17-10-7-13-28-21(17)20)23-22(16-8-3-1-4-9-16)29-24(27)25(30-23)31-19-11-5-2-6-12-19;1-30-11-9-18(14-30)31-24-23(26)28-21(15-6-3-2-4-7-15)22(29-24)17-12-16-8-5-10-27-20(16)19(25)13-17;25-19-13-17(12-16-8-4-11-28-20(16)19)22-21(15-6-2-1-3-7-15)29-23(26)24(30-22)31-18-9-5-10-27-14-18;1-3-30(4-2)15-31-24-23(26)28-21(16-9-6-5-7-10-16)22(29-24)18-13-17-11-8-12-27-20(17)19(25)14-18/h2-8,11,14-15,19H,9-10,12-13H2,1H3,(H2,27,29);1-15H,(H2,27,29);2-14H,1H3,(H2,26,28);1-14H,(H2,26,29);5-14H,3-4,15H2,1-2H3,(H2,26,28)
InChIKeyFUYADPUYVGSDJF-UHFFFAOYSA-N
XLogP30.74
TPSA347.75 Ų
H-Bond Donors5
H-Bond Acceptors29
Rotatable Bonds23
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002238.90
LogP ≤ 530.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

5-(8-Chloroquinolin-6-yl)-6-phenyl-3-[2-[3-(trifluoromethyl)pyrrol-1-yl]ethylsulfanyl]pyrazin-2-amine
CID 137430372
5-(8-Chloroquinolin-6-yl)-3-[(4-fluorophenyl)methylsulfanyl]-6-phenylpyrazin-2-amine
CID 137430380
3-(Azetidin-1-ylmethylsulfanyl)-5-(8-chloroquinolin-6-yl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-[(4-methylpiperazin-1-yl)methylsulfanyl]-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-(pyridin-3-ylmethylsulfanyl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-(2-pyrrolidin-1-ylethylsulfanyl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-[2-[3-(trifluoromethyl)pyrrol-1-yl]ethylsulfanyl]pyrazin-2-amine
CID 160596056
5-(8-Chloroquinolin-6-yl)-3-methyl-6-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-amine
CID 137430237
4-[[3-Amino-6-(8-chloroquinolin-6-yl)-5-phenylpyrazin-2-yl]sulfanylmethyl]benzonitrile
CID 137430373
5-(8-Chloroquinolin-6-yl)-6-phenyl-3-(pyridin-3-ylmethylsulfanyl)pyrazin-2-amine
CID 137430379
5-(8-Chloroquinolin-6-yl)-3-[[6-(methylamino)-3-pyridinyl]methylsulfanyl]-6-phenylpyrazin-2-amine
CID 137430401
5-(8-Chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine
CID 137430405
5-(8-Chloroquinolin-6-yl)-3-(2-cyclopentylethylsulfanyl)-6-phenylpyrazin-2-amine
CID 137430406
5-(8-Chloroquinolin-6-yl)-3-(cyclopropylmethylsulfanyl)-6-phenylpyrazin-2-amine
CID 137430407
5-(8-Chloroquinolin-6-yl)-3-[(1-methylpyrrolidin-3-yl)methylsulfanyl]-6-phenylpyrazin-2-amine
CID 137430408
5-(8-Chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine
CID 137430409

Frequently Asked Questions

What is the IUPAC name of 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine?
The IUPAC name of 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine (CID 158149592) is 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine.
What is the SMILES notation for 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine?
The canonical SMILES for 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine is CCN(CC)CSc1nc(-c2cc(Cl)c3ncccc3c2)c(-c2ccccc2)nc1N.CN1CCC(Sc2nc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2N)CC1.Cn1ccc(Sc2nc(-c3cc(Cl)c4ncccc4c3)c(-c3ccccc3)nc2N)c1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)nc1Sc1ccccc1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)nc1Sc1cccnc1.
What is the InChIKey of 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine?
The InChIKey is FUYADPUYVGSDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24ClN5S.C25H17ClN4S.C24H18ClN5S.C24H16ClN5S.C24H24ClN5S/c1-31-12-9-19(10-13-31)32-25-24(27)29-22(16-6-3-2-4-7-16)23(30-25)18-14-17-8-5-11-28-21(17)20(26)15-18;26-20-15-18(14-17-10-7-13-28-21(17)20)23-22(16-8-3-1-4-9-16)29-24(27)25(30-23)31-19-11-5-2-6-12-19;1-30-11-9-18(14-30)31-24-23(26)28-21(15-6-3-2-4-7-15)22(29-24)17-12-16-8-5-10-27-20(16)19(25)13-17;25-19-13-17(12-16-8-4-11-28-20(16)19)22-21(15-6-2-1-3-7-15)29-23(26)24(30-22)31-18-9-5-10-27-14-18;1-3-30(4-2)15-31-24-23(26)28-21(16-9-6-5-7-10-16)22(29-24)18-13-17-11-8-12-27-20(17)19(25)14-18/h2-8,11,14-15,19H,9-10,12-13H2,1H3,(H2,27,29);1-15H,(H2,27,29);2-14H,1H3,(H2,26,28);1-14H,(H2,26,29);5-14H,3-4,15H2,1-2H3,(H2,26,28).
What are the key properties of 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine?
5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine has a molecular weight of 2238.90 g/mol, XLogP of 30.74, 23 rotatable bonds, 5 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(8-chloroquinolin-6-yl)-3-(diethylaminomethylsulfanyl)-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpiperidin-4-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-(1-methylpyrrol-3-yl)sulfanyl-6-phenylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-phenylsulfanylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-6-phenyl-3-pyridin-3-ylsulfanylpyrazin-2-amine is sourced from PubChem (CID 158149592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).