1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine

C322H538N26OS — CID 157452860

IUPAC1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine
SMILESC1=Cc2ccccc2C1.C1=Cc2cccnc2C1.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)c1nc2ccccc2nc1C(C)(C)C.c1cc2ccsc2cn1.c1cc2cn[nH]c2cn1.c1ccc2ccccc2c1.c1ccc2cnccc2c1.c1ccc2cnccc2c1.c1ccc2ncccc2c1.c1ccc2ncccc2c1.c1ccc2nccnc2c1.c1ccc2occc2c1.c1cnc2[nH]ccc2c1.c1cnc2[nH]ccc2c1.c1cnc2[nH]ncc2c1.c1cnc2cccnc2c1.c1cnc2ccncc2c1.c1cnc2ccncc2c1
InChIInChI=1S/C16H22N2.C10H8.4C9H7N.C9H8.4C8H6N2.C8H7N.C8H6O.2C7H6N2.C7H5NS.2C6H5N3.34C5H12/c1-15(2,3)13-14(16(4,5)6)18-12-10-8-7-9-11(12)17-13;1-2-6-10-8-4-3-7-9(10)5-1;2*1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-4-9-7-10-6-5-8(9)3-1;1-2-5-9-7-3-6-8(9)4-1;1-3-7-8(9-5-1)4-2-6-10-7;2*1-2-7-6-9-5-3-8(7)10-4-1;1-2-4-8-7(3-1)9-5-6-10-8;1-3-7-4-2-6-9-8(7)5-1;1-2-4-8-7(3-1)5-6-9-8;2*1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-7-6(1)2-4-9-7;1-2-7-4-6-5(1)3-8-9-6;1-2-5-4-8-9-6(5)7-3-1;34*1-5(2,3)4/h7-10H,1-6H3;1-8H;4*1-7H;1-6H,7H2;4*1-6H;1-4,6H,5H2;1-6H;2*1-5H,(H,8,9);1-5H;1-4H,(H,8,9);1-4H,(H,7,8,9);34*1-4H3
InChIKeyBSZQHAAOPRBOGQ-UHFFFAOYSA-N
MW4822.09 g/mol
LogP105.98
Rot. Bonds

About 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine

1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine (PubChem CID 157452860) has the molecular formula C322H538N26OS and a molecular weight of 4822.09 g/mol. Its IUPAC name is 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine.

Molecular Properties

Compound Name1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine
PubChem CID157452860
Molecular FormulaC322H538N26OS
Molecular Weight4822.09 g/mol
Exact Mass4818.26
IUPAC Name1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine
SMILESC1=Cc2ccccc2C1.C1=Cc2cccnc2C1.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)c1nc2ccccc2nc1C(C)(C)C.c1cc2ccsc2cn1.c1cc2cn[nH]c2cn1.c1ccc2ccccc2c1.c1ccc2cnccc2c1.c1ccc2cnccc2c1.c1ccc2ncccc2c1.c1ccc2ncccc2c1.c1ccc2nccnc2c1.c1ccc2occc2c1.c1cnc2[nH]ccc2c1.c1cnc2[nH]ccc2c1.c1cnc2[nH]ncc2c1.c1cnc2cccnc2c1.c1cnc2ccncc2c1.c1cnc2ccncc2c1
InChIInChI=1S/C16H22N2.C10H8.4C9H7N.C9H8.4C8H6N2.C8H7N.C8H6O.2C7H6N2.C7H5NS.2C6H5N3.34C5H12/c1-15(2,3)13-14(16(4,5)6)18-12-10-8-7-9-11(12)17-13;1-2-6-10-8-4-3-7-9(10)5-1;2*1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-4-9-7-10-6-5-8(9)3-1;1-2-5-9-7-3-6-8(9)4-1;1-3-7-8(9-5-1)4-2-6-10-7;2*1-2-7-6-9-5-3-8(7)10-4-1;1-2-4-8-7(3-1)9-5-6-10-8;1-3-7-4-2-6-9-8(7)5-1;1-2-4-8-7(3-1)5-6-9-8;2*1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-7-6(1)2-4-9-7;1-2-7-4-6-5(1)3-8-9-6;1-2-5-4-8-9-6(5)7-3-1;34*1-5(2,3)4/h7-10H,1-6H3;1-8H;4*1-7H;1-6H,7H2;4*1-6H;1-4,6H,5H2;1-6H;2*1-5H,(H,8,9);1-5H;1-4H,(H,8,9);1-4H,(H,7,8,9);34*1-4H3
InChIKeyBSZQHAAOPRBOGQ-UHFFFAOYSA-N
XLogP105.98
TPSA359.88 Ų
H-Bond Donors4
H-Bond Acceptors24
Rotatable Bonds
Heavy Atoms350
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004822.09
LogP ≤ 5105.98
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1024

Analyze 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine with MolForge

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Related Compounds

6-tert-butyl-1H-benzimidazole;5-tert-butyl-2-benzothiophene;6-tert-butylcinnoline;4-tert-butyl-1,2-difluorobenzene;4-tert-butyl-1,2-dimethoxybenzene;2-tert-butyl-4-fluorofuran;1-tert-butyl-2-fluoro-3-(trifluoromethoxy)benzene;2-tert-butylfuran;5-tert-butyl-1H-indazole;5-tert-butyl-2H-isoindole;1-tert-butyl-4-methoxybenzene;2-tert-butylnaphthalene;7-tert-butylquinoline;6-tert-butylquinoxaline;2-tert-butylthiophene
CID 157050189
2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-(furan-3-yl)-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 157634317
tert-butylbenzene;bis(6-tert-butyl-1H-benzimidazole);1-tert-butylcyclopenta-1,3-diene;bis(2-tert-butylcyclopenta-1,3-diene);4-tert-butyl-1,1-difluorocyclohexane;bis(2-tert-butylfuran);3-tert-butyl-1H-indole;5-tert-butyl-1H-indole;6-tert-butyl-1H-indole;2-tert-butylnaphthalene;2-tert-butylpyridine;3-tert-butylpyridine;4-tert-butylpyridine;3-tert-butyl-1H-pyrrole;4-tert-butyl-2H-pyrrole;5-tert-butyl-2H-pyrrole;5-tert-butyl-3H-pyrrole;6-tert-butylquinoline;2-tert-butylthiophene;2-methylpropane;piperidine
CID 157716365
1-cyclopentyl-N-[[5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]methanamine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide;2-(5-pyrimidin-5-yl-2H-pyrazolo[3,4-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 158576601
2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine;N,N-dimethyl-5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine;3,3-dimethyl-N-[5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]butanamide;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-2,2-dimethylpropanamide;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]pentanamide
CID 158732130
2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine;N,N-dimethyl-5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine;5-[3-[7-(2-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-N-propan-2-ylpyridin-3-amine;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]pentanamide
CID 158741564
6-(1-tert-butylcyclopropyl)-1H-benzimidazole;6-(1-tert-butylcyclopropyl)cinnoline;5-(1-tert-butylcyclopropyl)-1H-indazole;(1-tert-butylcyclopropyl)methylbenzene;2-[(1-tert-butylcyclopropyl)methyl]-5-fluoropyridine;2-[(1-tert-butylcyclopropyl)methyl]furan;4-[(1-tert-butylcyclopropyl)methyl]pyridazine;2-[(1-tert-butylcyclopropyl)methyl]pyridine;3-[(1-tert-butylcyclopropyl)methyl]pyridine;4-[(1-tert-butylcyclopropyl)methyl]pyridine;6-[(1-tert-butylcyclopropyl)methyl]quinoline;6-[(1-tert-butylcyclopropyl)methyl]quinoxaline;2-[(1-tert-butylcyclopropyl)methyl]thiophene;2-[(1-tert-butylcyclopropyl)methyl]-5-(trifluoromethyl)pyridine;7-(1-tert-butylcyclopropyl)quinoline;6-(1-tert-butylcyclopropyl)quinoxaline
CID 158836849
N-[5-[3-[7-(3-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]cyclopropanecarboxamide;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]butanamide;N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide;2,2,2-trifluoro-N-[5-[3-[7-(3-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]acetamide
CID 159123278
N-[5-[3-[7-(2-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]butanamide;N-[5-[3-[7-(3-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]cyclopropanecarboxamide;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]butanamide;N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide;2,2,2-trifluoro-N-[5-[3-[7-(3-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]acetamide
CID 159218631
CID 159320113
CID 159320113
2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-(furan-3-yl)-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-(5-methyl-1H-imidazol-3-ium-3-yl)-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-c]pyridine;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 159968877
2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine;N,N-dimethyl-5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-2,2-dimethylpropanamide;N-[5-[3-[7-(furan-3-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]pentanamide
CID 160265792

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine?
The IUPAC name of 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine (CID 157452860) is 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine.
What is the SMILES notation for 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine?
The canonical SMILES for 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine is C1=Cc2ccccc2C1.C1=Cc2cccnc2C1.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)c1nc2ccccc2nc1C(C)(C)C.c1cc2ccsc2cn1.c1cc2cn[nH]c2cn1.c1ccc2ccccc2c1.c1ccc2cnccc2c1.c1ccc2cnccc2c1.c1ccc2ncccc2c1.c1ccc2ncccc2c1.c1ccc2nccnc2c1.c1ccc2occc2c1.c1cnc2[nH]ccc2c1.c1cnc2[nH]ccc2c1.c1cnc2[nH]ncc2c1.c1cnc2cccnc2c1.c1cnc2ccncc2c1.c1cnc2ccncc2c1.
What is the InChIKey of 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine?
The InChIKey is BSZQHAAOPRBOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2.C10H8.4C9H7N.C9H8.4C8H6N2.C8H7N.C8H6O.2C7H6N2.C7H5NS.2C6H5N3.34C5H12/c1-15(2,3)13-14(16(4,5)6)18-12-10-8-7-9-11(12)17-13;1-2-6-10-8-4-3-7-9(10)5-1;2*1-2-6-9-8(4-1)5-3-7-10-9;2*1-2-4-9-7-10-6-5-8(9)3-1;1-2-5-9-7-3-6-8(9)4-1;1-3-7-8(9-5-1)4-2-6-10-7;2*1-2-7-6-9-5-3-8(7)10-4-1;1-2-4-8-7(3-1)9-5-6-10-8;1-3-7-4-2-6-9-8(7)5-1;1-2-4-8-7(3-1)5-6-9-8;2*1-2-6-3-5-9-7(6)8-4-1;1-3-8-5-7-6(1)2-4-9-7;1-2-7-4-6-5(1)3-8-9-6;1-2-5-4-8-9-6(5)7-3-1;34*1-5(2,3)4/h7-10H,1-6H3;1-8H;4*1-7H;1-6H,7H2;4*1-6H;1-4,6H,5H2;1-6H;2*1-5H,(H,8,9);1-5H;1-4H,(H,8,9);1-4H,(H,7,8,9);34*1-4H3.
What are the key properties of 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine?
1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine has a molecular weight of 4822.09 g/mol, XLogP of 105.98, 0 rotatable bonds, 4 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran;7H-cyclopenta[b]pyridine;2,3-ditert-butylquinoxaline;(2,2-dimethylpropane);1H-indene;isoquinoline;naphthalene;1,5-naphthyridine;bis(1,6-naphthyridine);1H-pyrazolo[5,4-b]pyridine;1H-pyrazolo[5,4-c]pyridine;bis(1H-pyrrolo[2,3-b]pyridine);quinoline;quinoxaline;thieno[2,3-c]pyridine is sourced from PubChem (CID 157452860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).