bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine

C135H125N37O7S3 — CID 158031565

IUPACbis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine
SMILESCCc1cn(-c2ccnc3c2C=CC3)nc1C.Cc1cc(C)n(-c2ncnc3ccsc23)n1.Cc1cc(C)n(-c2ncnc3sccc23)n1.Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1ccc2c(ccn2C)c1.Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1cncnc1.Cc1nn(-c2ccnc3c2C=CC3)cc1-c1ccsc1.Cc1nn(-c2ccnc3c2C=CC3)cc1C1CCCC(O)C1.Cc1nn(-c2ncnc3ccccc23)c(C)c1C(=O)O.Cc1nn(-c2ncnc3ccccc23)c(C)c1CN.O=C=O.O=C=O
InChIInChI=1S/C20H17N5.C18H21N3O.C16H13N3S.C15H12N6.C14H15N5.C14H12N4O2.C14H15N3.2C11H10N4S.2CO2/c1-13-17(14-3-4-18-15(11-14)7-10-24(18)2)12-25(23-13)19-6-9-22-20-16(19)5-8-21-20;1-12-16(13-4-2-5-14(22)10-13)11-21(20-12)18-8-9-19-17-7-3-6-15(17)18;1-11-14(12-6-8-20-10-12)9-19(18-11)16-5-7-17-15-4-2-3-13(15)16;1-10-13(11-6-16-9-17-7-11)8-21(20-10)14-3-5-19-15-12(14)2-4-18-15;1-9-12(7-15)10(2)19(18-9)14-11-5-3-4-6-13(11)16-8-17-14;1-8-12(14(19)20)9(2)18(17-8)13-10-5-3-4-6-11(10)15-7-16-13;1-3-11-9-17(16-10(11)2)14-7-8-15-13-6-4-5-12(13)14;1-7-5-8(2)15(14-7)11-10-9(3-4-16-10)12-6-13-11;1-7-5-8(2)15(14-7)10-9-3-4-16-11(9)13-6-12-10;2*2-1-3/h3-12H,1-2H3,(H,21,22);3,6,8-9,11,13-14,22H,2,4-5,7,10H2,1H3;2-3,5-10H,4H2,1H3;2-9H,1H3,(H,18,19);3-6,8H,7,15H2,1-2H3;3-7H,1-2H3,(H,19,20);4-5,7-9H,3,6H2,1-2H3;2*3-6H,1-2H3;;
InChIKeyFHFXDHQJWGMAQC-UHFFFAOYSA-N
MW2473.94 g/mol
LogP24.32
Rot. Bonds16

About bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine

bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine (PubChem CID 158031565) has the molecular formula C135H125N37O7S3 and a molecular weight of 2473.94 g/mol. Its IUPAC name is bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine.

Molecular Properties

Compound Namebis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine
PubChem CID158031565
Molecular FormulaC135H125N37O7S3
Molecular Weight2473.94 g/mol
Exact Mass2471.97
IUPAC Namebis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine
SMILESCCc1cn(-c2ccnc3c2C=CC3)nc1C.Cc1cc(C)n(-c2ncnc3ccsc23)n1.Cc1cc(C)n(-c2ncnc3sccc23)n1.Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1ccc2c(ccn2C)c1.Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1cncnc1.Cc1nn(-c2ccnc3c2C=CC3)cc1-c1ccsc1.Cc1nn(-c2ccnc3c2C=CC3)cc1C1CCCC(O)C1.Cc1nn(-c2ncnc3ccccc23)c(C)c1C(=O)O.Cc1nn(-c2ncnc3ccccc23)c(C)c1CN.O=C=O.O=C=O
InChIInChI=1S/C20H17N5.C18H21N3O.C16H13N3S.C15H12N6.C14H15N5.C14H12N4O2.C14H15N3.2C11H10N4S.2CO2/c1-13-17(14-3-4-18-15(11-14)7-10-24(18)2)12-25(23-13)19-6-9-22-20-16(19)5-8-21-20;1-12-16(13-4-2-5-14(22)10-13)11-21(20-12)18-8-9-19-17-7-3-6-15(17)18;1-11-14(12-6-8-20-10-12)9-19(18-11)16-5-7-17-15-4-2-3-13(15)16;1-10-13(11-6-16-9-17-7-11)8-21(20-10)14-3-5-19-15-12(14)2-4-18-15;1-9-12(7-15)10(2)19(18-9)14-11-5-3-4-6-13(11)16-8-17-14;1-8-12(14(19)20)9(2)18(17-8)13-10-5-3-4-6-11(10)15-7-16-13;1-3-11-9-17(16-10(11)2)14-7-8-15-13-6-4-5-12(13)14;1-7-5-8(2)15(14-7)11-10-9(3-4-16-10)12-6-13-11;1-7-5-8(2)15(14-7)10-9-3-4-16-11(9)13-6-12-10;2*2-1-3/h3-12H,1-2H3,(H,21,22);3,6,8-9,11,13-14,22H,2,4-5,7,10H2,1H3;2-3,5-10H,4H2,1H3;2-9H,1H3,(H,18,19);3-6,8H,7,15H2,1-2H3;3-7H,1-2H3,(H,19,20);4-5,7-9H,3,6H2,1-2H3;2*3-6H,1-2H3;;
InChIKeyFHFXDHQJWGMAQC-UHFFFAOYSA-N
XLogP24.32
TPSA542.07 Ų
H-Bond Donors5
H-Bond Acceptors44
Rotatable Bonds16
Heavy Atoms182
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002473.94
LogP ≤ 524.32
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1044

Analyze bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine with MolForge

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Launch Full Analysis

Related Compounds

bis(carbon dioxide);1-[4-(3,5-dimethylpyrazol-1-yl)-2-pyridinyl]ethanone;N-ethanimidoyl-4-methyl-1-quinolin-4-ylpyrrole-3-carboxamide;1-(3-ethyl-1-quinolin-4-ylpyrazol-4-yl)ethanone;4-(3-methylpyrrol-1-yl)pyridine-2-carboxamide;1-(4-methyl-1-quinolin-4-ylpyrrol-3-yl)ethanone;4-methyl-1-thieno[2,3-d]pyrimidin-4-ylpyrrole-3-carboxylic acid;4-methyl-1-thieno[3,2-d]pyrimidin-4-ylpyrrole-3-carboxylic acid
CID 158887929
bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;bis(1-[4-(3,5-dimethylpyrazol-1-yl)-2-pyridinyl]ethanone);1-(3H-isoindol-1-yl)-3,5-dimethylpyrazole-4-carboxylic acid;1-[1-(3H-isoindol-1-yl)-3,5-dimethylpyrazol-4-yl]ethanone;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;1-(3-methyl-1-quinolin-4-ylpyrazol-4-yl)ethanone;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine
CID 161250885
tris(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;tris(1-[4-(3,5-dimethylpyrazol-1-yl)-2-pyridinyl]ethanone);1-(3H-isoindol-1-yl)-3,5-dimethylpyrazole-4-carboxylic acid;1-[1-(3H-isoindol-1-yl)-3,5-dimethylpyrazol-4-yl]ethanone;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;1-(3-methyl-1-quinolin-4-ylpyrazol-4-yl)ethanone;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine
CID 161308507
carbon dioxide;3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;1-[4-(3,5-dimethylpyrazol-1-yl)-2-pyridinyl]ethanone;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;1-(3H-isoindol-1-yl)-3,5-dimethylpyrazole-4-carboxylic acid;1-[1-(3H-isoindol-1-yl)-3,5-dimethylpyrazol-4-yl]ethanone;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;1-(3-methyl-1-quinolin-4-ylpyrazol-4-yl)ethanone;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine
CID 161790357
1-cyclohexyl-7H-pyrrolo[2,3-h][1,6]naphthyridin-4-one;bis(1-(5-hydroxy-2-adamantyl)-7H-pyrrolo[2,3-h][1,6]naphthyridin-4-one);1-[4-(hydroxymethyl)cyclohexyl]-3,7-dihydro-2H-pyrrolo[2,3-h][1,6]naphthyridin-4-one;1-(4-methoxycyclohexyl)-7H-pyrrolo[2,3-h][1,6]naphthyridin-4-one;1-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]-7H-pyrrolo[2,3-h][1,6]naphthyridin-4-one
CID 161797620

Frequently Asked Questions

What is the IUPAC name of bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine?
The IUPAC name of bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine (CID 158031565) is bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine.
What is the SMILES notation for bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine?
The canonical SMILES for bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine is CCc1cn(-c2ccnc3c2C=CC3)nc1C.Cc1cc(C)n(-c2ncnc3ccsc23)n1.Cc1cc(C)n(-c2ncnc3sccc23)n1.Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1ccc2c(ccn2C)c1.Cc1nn(-c2ccnc3[nH]ccc23)cc1-c1cncnc1.Cc1nn(-c2ccnc3c2C=CC3)cc1-c1ccsc1.Cc1nn(-c2ccnc3c2C=CC3)cc1C1CCCC(O)C1.Cc1nn(-c2ncnc3ccccc23)c(C)c1C(=O)O.Cc1nn(-c2ncnc3ccccc23)c(C)c1CN.O=C=O.O=C=O.
What is the InChIKey of bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine?
The InChIKey is FHFXDHQJWGMAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5.C18H21N3O.C16H13N3S.C15H12N6.C14H15N5.C14H12N4O2.C14H15N3.2C11H10N4S.2CO2/c1-13-17(14-3-4-18-15(11-14)7-10-24(18)2)12-25(23-13)19-6-9-22-20-16(19)5-8-21-20;1-12-16(13-4-2-5-14(22)10-13)11-21(20-12)18-8-9-19-17-7-3-6-15(17)18;1-11-14(12-6-8-20-10-12)9-19(18-11)16-5-7-17-15-4-2-3-13(15)16;1-10-13(11-6-16-9-17-7-11)8-21(20-10)14-3-5-19-15-12(14)2-4-18-15;1-9-12(7-15)10(2)19(18-9)14-11-5-3-4-6-13(11)16-8-17-14;1-8-12(14(19)20)9(2)18(17-8)13-10-5-3-4-6-11(10)15-7-16-13;1-3-11-9-17(16-10(11)2)14-7-8-15-13-6-4-5-12(13)14;1-7-5-8(2)15(14-7)11-10-9(3-4-16-10)12-6-13-11;1-7-5-8(2)15(14-7)10-9-3-4-16-11(9)13-6-12-10;2*2-1-3/h3-12H,1-2H3,(H,21,22);3,6,8-9,11,13-14,22H,2,4-5,7,10H2,1H3;2-3,5-10H,4H2,1H3;2-9H,1H3,(H,18,19);3-6,8H,7,15H2,1-2H3;3-7H,1-2H3,(H,19,20);4-5,7-9H,3,6H2,1-2H3;2*3-6H,1-2H3;;.
What are the key properties of bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine?
bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine has a molecular weight of 2473.94 g/mol, XLogP of 24.32, 16 rotatable bonds, 5 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for bis(carbon dioxide);3-[1-(7H-cyclopenta[b]pyridin-4-yl)-3-methylpyrazol-4-yl]cyclohexan-1-ol;4-(3,5-dimethylpyrazol-1-yl)thieno[2,3-d]pyrimidine;4-(3,5-dimethylpyrazol-1-yl)thieno[3,2-d]pyrimidine;3,5-dimethyl-1-quinazolin-4-ylpyrazole-4-carboxylic acid;(3,5-dimethyl-1-quinazolin-4-ylpyrazol-4-yl)methanamine;4-(4-ethyl-3-methylpyrazol-1-yl)-7H-cyclopenta[b]pyridine;4-[3-methyl-4-(1-methylindol-5-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-pyrimidin-5-ylpyrazol-1-yl)-1H-pyrrolo[2,3-b]pyridine;4-(3-methyl-4-thiophen-3-ylpyrazol-1-yl)-7H-cyclopenta[b]pyridine is sourced from PubChem (CID 158031565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).