N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine

C125H95Cl8FN24S6 — CID 158930260

IUPACN-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine
SMILESCc1cccc(C)c1Nc1c(-c2ccncc2Cl)nc2sc3ccccc3n12.Cc1cccc(Cl)c1Nc1c(-c2ccncc2Cl)nc2sc3ccccc3n12.Cc1cccc(Cl)c1Nc1c(-c2ccncc2Cl)nc2scc(-c3ccccc3)n12.Clc1cnccc1-c1nc2sc3ccccc3n2c1NC1CCCC1.Clc1cnccc1-c1nc2sc3ccccc3n2c1NC1CCCCC1.Fc1ccc(Nc2c(-c3ccncc3Cl)nc3sc4ccccc4n23)cc1
InChIInChI=1S/C23H16Cl2N4S.C22H17ClN4S.C21H14Cl2N4S.C20H12ClFN4S.C20H19ClN4S.C19H17ClN4S/c1-14-6-5-9-17(24)20(14)27-22-21(16-10-11-26-12-18(16)25)28-23-29(22)19(13-30-23)15-7-3-2-4-8-15;1-13-6-5-7-14(2)19(13)25-21-20(15-10-11-24-12-16(15)23)26-22-27(21)17-8-3-4-9-18(17)28-22;1-12-5-4-6-14(22)18(12)25-20-19(13-9-10-24-11-15(13)23)26-21-27(20)16-7-2-3-8-17(16)28-21;21-15-11-23-10-9-14(15)18-19(24-13-7-5-12(22)6-8-13)26-16-3-1-2-4-17(16)27-20(26)25-18;21-15-12-22-11-10-14(15)18-19(23-13-6-2-1-3-7-13)25-16-8-4-5-9-17(16)26-20(25)24-18;20-14-11-21-10-9-13(14)17-18(22-12-5-1-2-6-12)24-15-7-3-4-8-16(15)25-19(24)23-17/h2-13,27H,1H3;3-12,25H,1-2H3;2-11,25H,1H3;1-11,24H;4-5,8-13,23H,1-3,6-7H2;3-4,7-12,22H,1-2,5-6H2
InChIKeyJIYRBJKLXQWDFO-UHFFFAOYSA-N
MW2428.33 g/mol
LogP38.85
Rot. Bonds19

About N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine

N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine (PubChem CID 158930260) has the molecular formula C125H95Cl8FN24S6 and a molecular weight of 2428.33 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine
PubChem CID158930260
Molecular FormulaC125H95Cl8FN24S6
Molecular Weight2428.33 g/mol
Exact Mass2422.40
IUPAC NameN-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine
SMILESCc1cccc(C)c1Nc1c(-c2ccncc2Cl)nc2sc3ccccc3n12.Cc1cccc(Cl)c1Nc1c(-c2ccncc2Cl)nc2sc3ccccc3n12.Cc1cccc(Cl)c1Nc1c(-c2ccncc2Cl)nc2scc(-c3ccccc3)n12.Clc1cnccc1-c1nc2sc3ccccc3n2c1NC1CCCC1.Clc1cnccc1-c1nc2sc3ccccc3n2c1NC1CCCCC1.Fc1ccc(Nc2c(-c3ccncc3Cl)nc3sc4ccccc4n23)cc1
InChIInChI=1S/C23H16Cl2N4S.C22H17ClN4S.C21H14Cl2N4S.C20H12ClFN4S.C20H19ClN4S.C19H17ClN4S/c1-14-6-5-9-17(24)20(14)27-22-21(16-10-11-26-12-18(16)25)28-23-29(22)19(13-30-23)15-7-3-2-4-8-15;1-13-6-5-7-14(2)19(13)25-21-20(15-10-11-24-12-16(15)23)26-22-27(21)17-8-3-4-9-18(17)28-22;1-12-5-4-6-14(22)18(12)25-20-19(13-9-10-24-11-15(13)23)26-21-27(20)16-7-2-3-8-17(16)28-21;21-15-11-23-10-9-14(15)18-19(24-13-7-5-12(22)6-8-13)26-16-3-1-2-4-17(16)27-20(26)25-18;21-15-12-22-11-10-14(15)18-19(23-13-6-2-1-3-7-13)25-16-8-4-5-9-17(16)26-20(25)24-18;20-14-11-21-10-9-13(14)17-18(22-12-5-1-2-6-12)24-15-7-3-4-8-16(15)25-19(24)23-17/h2-13,27H,1H3;3-12,25H,1-2H3;2-11,25H,1H3;1-11,24H;4-5,8-13,23H,1-3,6-7H2;3-4,7-12,22H,1-2,5-6H2
InChIKeyJIYRBJKLXQWDFO-UHFFFAOYSA-N
XLogP38.85
TPSA253.32 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds19
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002428.33
LogP ≤ 538.85
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Analyze N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine?
The IUPAC name of N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine (CID 158930260) is N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine is Cc1cccc(C)c1Nc1c(-c2ccncc2Cl)nc2sc3ccccc3n12.Cc1cccc(Cl)c1Nc1c(-c2ccncc2Cl)nc2sc3ccccc3n12.Cc1cccc(Cl)c1Nc1c(-c2ccncc2Cl)nc2scc(-c3ccccc3)n12.Clc1cnccc1-c1nc2sc3ccccc3n2c1NC1CCCC1.Clc1cnccc1-c1nc2sc3ccccc3n2c1NC1CCCCC1.Fc1ccc(Nc2c(-c3ccncc3Cl)nc3sc4ccccc4n23)cc1.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine?
The InChIKey is JIYRBJKLXQWDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16Cl2N4S.C22H17ClN4S.C21H14Cl2N4S.C20H12ClFN4S.C20H19ClN4S.C19H17ClN4S/c1-14-6-5-9-17(24)20(14)27-22-21(16-10-11-26-12-18(16)25)28-23-29(22)19(13-30-23)15-7-3-2-4-8-15;1-13-6-5-7-14(2)19(13)25-21-20(15-10-11-24-12-16(15)23)26-22-27(21)17-8-3-4-9-18(17)28-22;1-12-5-4-6-14(22)18(12)25-20-19(13-9-10-24-11-15(13)23)26-21-27(20)16-7-2-3-8-17(16)28-21;21-15-11-23-10-9-14(15)18-19(24-13-7-5-12(22)6-8-13)26-16-3-1-2-4-17(16)27-20(26)25-18;21-15-12-22-11-10-14(15)18-19(23-13-6-2-1-3-7-13)25-16-8-4-5-9-17(16)26-20(25)24-18;20-14-11-21-10-9-13(14)17-18(22-12-5-1-2-6-12)24-15-7-3-4-8-16(15)25-19(24)23-17/h2-13,27H,1H3;3-12,25H,1-2H3;2-11,25H,1H3;1-11,24H;4-5,8-13,23H,1-3,6-7H2;3-4,7-12,22H,1-2,5-6H2.
What are the key properties of N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine?
N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine has a molecular weight of 2428.33 g/mol, XLogP of 38.85, 19 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-2-(3-chloro-4-pyridinyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;N-(2-chloro-6-methylphenyl)-6-(3-chloro-4-pyridinyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine;2-(3-chloro-4-pyridinyl)-N-cyclohexylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-cyclopentylimidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(2,6-dimethylphenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine;2-(3-chloro-4-pyridinyl)-N-(4-fluorophenyl)imidazo[2,1-b][1,3]benzothiazol-1-amine is sourced from PubChem (CID 158930260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).