4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine

C75H45Cl8N21O2S4 — CID 157301592

IUPAC4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine
SMILESClc1ccc(-c2nc(-c3ccnc4[nH]ccc34)sc2-c2ncc[nH]2)c(Cl)c1.Nc1cc(-c2nc(-c3ccc(Cl)cc3Cl)c(-c3ncc[nH]3)s2)ncn1.O=C1CCc2c(-c3nc(-c4ccc(Cl)cc4Cl)c(-c4ncc[nH]4)s3)ccnc2N1.O=c1ccc2c(-c3nc(-c4ccc(Cl)cc4Cl)c(-c4ncc[nH]4)s3)ccnc2[nH]1
InChIInChI=1S/C20H13Cl2N5OS.C20H11Cl2N5OS.C19H11Cl2N5S.C16H10Cl2N6S/c2*21-10-1-2-13(14(22)9-10)16-17(19-24-7-8-25-19)29-20(27-16)12-5-6-23-18-11(12)3-4-15(28)26-18;20-10-1-2-13(14(21)9-10)15-16(18-24-7-8-25-18)27-19(26-15)12-4-6-23-17-11(12)3-5-22-17;17-8-1-2-9(10(18)5-8)13-14(15-20-3-4-21-15)25-16(24-13)11-6-12(19)23-7-22-11/h1-2,5-9H,3-4H2,(H,24,25)(H,23,26,28);1-9H,(H,24,25)(H,23,26,28);1-9H,(H,22,23)(H,24,25);1-7H,(H,20,21)(H2,19,22,23)
InChIKeyBBYRLUTYXABUPW-UHFFFAOYSA-N
MW1684.22 g/mol
LogP21.46
Rot. Bonds12

About 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine

4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine (PubChem CID 157301592) has the molecular formula C75H45Cl8N21O2S4 and a molecular weight of 1684.22 g/mol. Its IUPAC name is 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine
PubChem CID157301592
Molecular FormulaC75H45Cl8N21O2S4
Molecular Weight1684.22 g/mol
Exact Mass1679.05
IUPAC Name4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine
SMILESClc1ccc(-c2nc(-c3ccnc4[nH]ccc34)sc2-c2ncc[nH]2)c(Cl)c1.Nc1cc(-c2nc(-c3ccc(Cl)cc3Cl)c(-c3ncc[nH]3)s2)ncn1.O=C1CCc2c(-c3nc(-c4ccc(Cl)cc4Cl)c(-c4ncc[nH]4)s3)ccnc2N1.O=c1ccc2c(-c3nc(-c4ccc(Cl)cc4Cl)c(-c4ncc[nH]4)s3)ccnc2[nH]1
InChIInChI=1S/C20H13Cl2N5OS.C20H11Cl2N5OS.C19H11Cl2N5S.C16H10Cl2N6S/c2*21-10-1-2-13(14(22)9-10)16-17(19-24-7-8-25-19)29-20(27-16)12-5-6-23-18-11(12)3-4-15(28)26-18;20-10-1-2-13(14(21)9-10)15-16(18-24-7-8-25-18)27-19(26-15)12-4-6-23-17-11(12)3-5-22-17;17-8-1-2-9(10(18)5-8)13-14(15-20-3-4-21-15)25-16(24-13)11-6-12(19)23-7-22-11/h1-2,5-9H,3-4H2,(H,24,25)(H,23,26,28);1-9H,(H,24,25)(H,23,26,28);1-9H,(H,22,23)(H,24,25);1-7H,(H,20,21)(H2,19,22,23)
InChIKeyBBYRLUTYXABUPW-UHFFFAOYSA-N
XLogP21.46
TPSA334.50 Ų
H-Bond Donors8
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms110
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001684.22
LogP ≤ 521.46
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1020

Analyze 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine with MolForge

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Related Compounds

N-[4-[4-(4-chloro-3-methylphenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[4-(2-chloro-4-methylphenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[4-(3-chlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2-chlorophenyl)-5-(4-methylpentanoyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(1,3-dimethylpyrazol-4-yl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide
CID 157509147
2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-trimethylstannyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 158493204
2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;5-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]piperidin-2-one;5-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]piperidin-2-one;5-trimethylstannyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 158809139
N-[4-[4-(1-benzothiophen-3-yl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;6-[4-(2-chloro-4-methylphenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine;1-[4-[4-(2,4-dichlorophenyl)-5-(5-methyl-1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one;N-[4-[5-(1H-imidazol-2-yl)-4-(2-methylphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[5-(1H-imidazol-2-yl)-4-(3-methylphenyl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;1-[4-[5-(1H-imidazol-2-yl)-4-[3-(prop-1-en-2-ylamino)phenyl]-1,3-thiazol-2-yl]-2-pyridinyl]propan-2-one
CID 159415577
N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide
CID 159484882
4-(2-chloro-4-methylphenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2-chloro-4-methylphenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2-chloro-4-methylphenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;methane
CID 160725626
2-chloro-7-[6-(2-chlorophenyl)sulfanyl-2-pyridinyl]-5H-pyrrolo[2,3-b]pyrazine;3-chloro-N-[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]benzamide;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(3,4-dichlorophenyl)methyl]pyridin-2-amine;6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-N-[(1S)-1-phenylethyl]pyridin-2-amine;N-[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]benzamide;N-[6-(2-chloro-5H-pyrrolo[2,3-b]pyrazin-7-yl)-2-pyridinyl]pyridine-3-carboxamide
CID 160738698
2-bromo-4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazole;N-[4-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-[4-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)-1,3-thiazol-2-yl]-2-pyridinyl]acetamide;N-(4-trimethylstannyl-2-pyridinyl)acetamide
CID 161202392
acetyl chloride;N-tert-butyl-7-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)thiophen-2-yl]-[1,3]thiazolo[5,4-d]pyrimidin-2-amine;N-[7-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)thiophen-2-yl]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]acetamide;7-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)thiophen-2-yl]-[1,3]thiazolo[5,4-d]pyrimidin-2-amine;N-[7-[4-(2,4-dichlorophenyl)-5-(1-prop-2-enylimidazol-2-yl)thiophen-2-yl]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]acetamide
CID 161670598

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine?
The IUPAC name of 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine (CID 157301592) is 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine.
What is the SMILES notation for 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine?
The canonical SMILES for 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine is Clc1ccc(-c2nc(-c3ccnc4[nH]ccc34)sc2-c2ncc[nH]2)c(Cl)c1.Nc1cc(-c2nc(-c3ccc(Cl)cc3Cl)c(-c3ncc[nH]3)s2)ncn1.O=C1CCc2c(-c3nc(-c4ccc(Cl)cc4Cl)c(-c4ncc[nH]4)s3)ccnc2N1.O=c1ccc2c(-c3nc(-c4ccc(Cl)cc4Cl)c(-c4ncc[nH]4)s3)ccnc2[nH]1.
What is the InChIKey of 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine?
The InChIKey is BBYRLUTYXABUPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13Cl2N5OS.C20H11Cl2N5OS.C19H11Cl2N5S.C16H10Cl2N6S/c2*21-10-1-2-13(14(22)9-10)16-17(19-24-7-8-25-19)29-20(27-16)12-5-6-23-18-11(12)3-4-15(28)26-18;20-10-1-2-13(14(21)9-10)15-16(18-24-7-8-25-18)27-19(26-15)12-4-6-23-17-11(12)3-5-22-17;17-8-1-2-9(10(18)5-8)13-14(15-20-3-4-21-15)25-16(24-13)11-6-12(19)23-7-22-11/h1-2,5-9H,3-4H2,(H,24,25)(H,23,26,28);1-9H,(H,24,25)(H,23,26,28);1-9H,(H,22,23)(H,24,25);1-7H,(H,20,21)(H2,19,22,23).
What are the key properties of 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine?
4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine has a molecular weight of 1684.22 g/mol, XLogP of 21.46, 12 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazole;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-3,4-dihydro-1H-1,8-naphthyridin-2-one;5-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]-1H-1,8-naphthyridin-2-one;6-[4-(2,4-dichlorophenyl)-5-(1H-imidazol-2-yl)-1,3-thiazol-2-yl]pyrimidin-4-amine is sourced from PubChem (CID 157301592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).