tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine

C248H197N91O6S6 — CID 157241333

IUPACtris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine
SMILESC1=Cc2ncncc2C1.C1=Cc2nnccc2C1.C1=c2ccnnc2=CC1.C1=c2ccnnc2=CC1.C1=c2ccnnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.c1cc2cc[nH]c2nn1.c1cc2ccncn2c1.c1cc2ccnn2cn1.c1cc2ccoc2nn1.c1cc2ccsc2nn1.c1cc2cnccn2c1.c1cc2cnncc2[nH]1.c1cc2cnncc2o1.c1cc2cnncc2s1.c1cc2nccn2cn1.c1cc2occc2nn1.c1cc2sccc2nn1.c1ccn2ccnc2c1.c1ccn2nccc2c1.c1ccn2ncnc2c1.c1cn2ccnc2cn1.c1cn2nccc2cn1.c1cnc2[nH]ccc2n1.c1cnc2cccn2c1.c1cnc2ccnn2c1.c1cnc2nccn2c1.c1cnc2occc2n1.c1cnc2sccc2n1.c1cnn2cccc2c1.c1cnn2ccnc2c1.c1cnn2nccc2c1.c1ncc2cc[nH]c2n1.c1ncc2ccoc2n1.c1ncc2ccsc2n1.c1ncc2occc2n1.c1ncc2sccc2n1
InChIInChI=1S/14C7H6N2.13C6H5N3.6C6H4N2O.6C6H4N2S/c1-3-7-8-4-2-6-9(7)5-1;1-3-7-4-2-6-9(7)8-5-1;1-2-7-3-4-8-6-9(7)5-1;1-2-7-6-8-3-5-9(7)4-1;1-2-6-4-8-5-9-7(6)3-1;3*1-2-6-7(3-1)9-5-4-8-6;1-2-6-9-7(3-1)4-5-8-9;4*1-2-6-4-5-8-9-7(6)3-1;1-2-5-9-6-4-8-7(9)3-1;1-3-9-4-2-8-6(9)5-7-1;1-3-7-5-9-6(1)2-4-8-9;1-3-7-6-2-4-8-9(6)5-1;1-3-7-6-5(1)2-4-8-9-6;1-2-8-6-5(1)3-7-4-9-6;1-2-7-6-4-9-8-3-5(1)6;1-2-7-5-9-4-3-8-6(1)9;1-2-8-9-4-3-7-5-6(1)9;1-2-8-6-5(1)7-3-4-9-6;1-2-7-6-8-3-5-9(6)4-1;1-2-6-3-5-8-9(6)7-4-1;1-2-6-7-4-5-9(6)8-3-1;1-2-4-9-6(3-1)7-5-8-9;1-4-9-6-5(1)7-2-3-8-6;1-3-7-8-5-2-4-9-6(1)5;1-3-7-8-6-5(1)2-4-9-6;1-2-9-6-3-7-4-8-5(1)6;1-2-9-6-5(1)3-7-4-8-6;1-2-9-6-4-8-7-3-5(1)6;1-4-9-6-5(1)7-2-3-8-6;1-3-7-8-5-2-4-9-6(1)5;1-3-7-8-6-5(1)2-4-9-6;1-2-9-6-3-7-4-8-5(1)6;1-2-9-6-5(1)3-7-4-8-6;1-2-9-6-4-8-7-3-5(1)6/h4*1-6H;1,3-5H,2H2;3*2-5H,1H2;1-6H;3*2-5H,1H2;1,3-5H,2H2;1-6H;3*1-5H;1-4H,(H,7,9);1-4H,(H,7,8,9);1-4,7H;2*1-5H;1-4H,(H,8,9);4*1-5H;12*1-4H
InChIKeyAVGDCYSCPNCBJR-UHFFFAOYSA-N
MW4740.34 g/mol
LogP34.63
Rot. Bonds

About tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine

tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 157241333) has the molecular formula C248H197N91O6S6 and a molecular weight of 4740.34 g/mol. Its IUPAC name is tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Nametris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine
PubChem CID157241333
Molecular FormulaC248H197N91O6S6
Molecular Weight4740.34 g/mol
Exact Mass4736.62
IUPAC Nametris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine
SMILESC1=Cc2ncncc2C1.C1=Cc2nnccc2C1.C1=c2ccnnc2=CC1.C1=c2ccnnc2=CC1.C1=c2ccnnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.c1cc2cc[nH]c2nn1.c1cc2ccncn2c1.c1cc2ccnn2cn1.c1cc2ccoc2nn1.c1cc2ccsc2nn1.c1cc2cnccn2c1.c1cc2cnncc2[nH]1.c1cc2cnncc2o1.c1cc2cnncc2s1.c1cc2nccn2cn1.c1cc2occc2nn1.c1cc2sccc2nn1.c1ccn2ccnc2c1.c1ccn2nccc2c1.c1ccn2ncnc2c1.c1cn2ccnc2cn1.c1cn2nccc2cn1.c1cnc2[nH]ccc2n1.c1cnc2cccn2c1.c1cnc2ccnn2c1.c1cnc2nccn2c1.c1cnc2occc2n1.c1cnc2sccc2n1.c1cnn2cccc2c1.c1cnn2ccnc2c1.c1cnn2nccc2c1.c1ncc2cc[nH]c2n1.c1ncc2ccoc2n1.c1ncc2ccsc2n1.c1ncc2occc2n1.c1ncc2sccc2n1
InChIInChI=1S/14C7H6N2.13C6H5N3.6C6H4N2O.6C6H4N2S/c1-3-7-8-4-2-6-9(7)5-1;1-3-7-4-2-6-9(7)8-5-1;1-2-7-3-4-8-6-9(7)5-1;1-2-7-6-8-3-5-9(7)4-1;1-2-6-4-8-5-9-7(6)3-1;3*1-2-6-7(3-1)9-5-4-8-6;1-2-6-9-7(3-1)4-5-8-9;4*1-2-6-4-5-8-9-7(6)3-1;1-2-5-9-6-4-8-7(9)3-1;1-3-9-4-2-8-6(9)5-7-1;1-3-7-5-9-6(1)2-4-8-9;1-3-7-6-2-4-8-9(6)5-1;1-3-7-6-5(1)2-4-8-9-6;1-2-8-6-5(1)3-7-4-9-6;1-2-7-6-4-9-8-3-5(1)6;1-2-7-5-9-4-3-8-6(1)9;1-2-8-9-4-3-7-5-6(1)9;1-2-8-6-5(1)7-3-4-9-6;1-2-7-6-8-3-5-9(6)4-1;1-2-6-3-5-8-9(6)7-4-1;1-2-6-7-4-5-9(6)8-3-1;1-2-4-9-6(3-1)7-5-8-9;1-4-9-6-5(1)7-2-3-8-6;1-3-7-8-5-2-4-9-6(1)5;1-3-7-8-6-5(1)2-4-9-6;1-2-9-6-3-7-4-8-5(1)6;1-2-9-6-5(1)3-7-4-8-6;1-2-9-6-4-8-7-3-5(1)6;1-4-9-6-5(1)7-2-3-8-6;1-3-7-8-5-2-4-9-6(1)5;1-3-7-8-6-5(1)2-4-9-6;1-2-9-6-3-7-4-8-5(1)6;1-2-9-6-5(1)3-7-4-8-6;1-2-9-6-4-8-7-3-5(1)6/h4*1-6H;1,3-5H,2H2;3*2-5H,1H2;1-6H;3*2-5H,1H2;1,3-5H,2H2;1-6H;3*1-5H;1-4H,(H,7,9);1-4H,(H,7,8,9);1-4,7H;2*1-5H;1-4H,(H,8,9);4*1-5H;12*1-4H
InChIKeyAVGDCYSCPNCBJR-UHFFFAOYSA-N
XLogP34.63
TPSA1136.23 Ų
H-Bond Donors4
H-Bond Acceptors99
Rotatable Bonds
Heavy Atoms351
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004740.34
LogP ≤ 534.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1099

Analyze tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine (CID 157241333) is tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine is C1=Cc2ncncc2C1.C1=Cc2nnccc2C1.C1=c2ccnnc2=CC1.C1=c2ccnnc2=CC1.C1=c2ccnnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.c1cc2cc[nH]c2nn1.c1cc2ccncn2c1.c1cc2ccnn2cn1.c1cc2ccoc2nn1.c1cc2ccsc2nn1.c1cc2cnccn2c1.c1cc2cnncc2[nH]1.c1cc2cnncc2o1.c1cc2cnncc2s1.c1cc2nccn2cn1.c1cc2occc2nn1.c1cc2sccc2nn1.c1ccn2ccnc2c1.c1ccn2nccc2c1.c1ccn2ncnc2c1.c1cn2ccnc2cn1.c1cn2nccc2cn1.c1cnc2[nH]ccc2n1.c1cnc2cccn2c1.c1cnc2ccnn2c1.c1cnc2nccn2c1.c1cnc2occc2n1.c1cnc2sccc2n1.c1cnn2cccc2c1.c1cnn2ccnc2c1.c1cnn2nccc2c1.c1ncc2cc[nH]c2n1.c1ncc2ccoc2n1.c1ncc2ccsc2n1.c1ncc2occc2n1.c1ncc2sccc2n1.
What is the InChIKey of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is AVGDCYSCPNCBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/14C7H6N2.13C6H5N3.6C6H4N2O.6C6H4N2S/c1-3-7-8-4-2-6-9(7)5-1;1-3-7-4-2-6-9(7)8-5-1;1-2-7-3-4-8-6-9(7)5-1;1-2-7-6-8-3-5-9(7)4-1;1-2-6-4-8-5-9-7(6)3-1;3*1-2-6-7(3-1)9-5-4-8-6;1-2-6-9-7(3-1)4-5-8-9;4*1-2-6-4-5-8-9-7(6)3-1;1-2-5-9-6-4-8-7(9)3-1;1-3-9-4-2-8-6(9)5-7-1;1-3-7-5-9-6(1)2-4-8-9;1-3-7-6-2-4-8-9(6)5-1;1-3-7-6-5(1)2-4-8-9-6;1-2-8-6-5(1)3-7-4-9-6;1-2-7-6-4-9-8-3-5(1)6;1-2-7-5-9-4-3-8-6(1)9;1-2-8-9-4-3-7-5-6(1)9;1-2-8-6-5(1)7-3-4-9-6;1-2-7-6-8-3-5-9(6)4-1;1-2-6-3-5-8-9(6)7-4-1;1-2-6-7-4-5-9(6)8-3-1;1-2-4-9-6(3-1)7-5-8-9;1-4-9-6-5(1)7-2-3-8-6;1-3-7-8-5-2-4-9-6(1)5;1-3-7-8-6-5(1)2-4-9-6;1-2-9-6-3-7-4-8-5(1)6;1-2-9-6-5(1)3-7-4-8-6;1-2-9-6-4-8-7-3-5(1)6;1-4-9-6-5(1)7-2-3-8-6;1-3-7-8-5-2-4-9-6(1)5;1-3-7-8-6-5(1)2-4-9-6;1-2-9-6-3-7-4-8-5(1)6;1-2-9-6-5(1)3-7-4-8-6;1-2-9-6-4-8-7-3-5(1)6/h4*1-6H;1,3-5H,2H2;3*2-5H,1H2;1-6H;3*2-5H,1H2;1,3-5H,2H2;1-6H;3*1-5H;1-4H,(H,7,9);1-4H,(H,7,8,9);1-4,7H;2*1-5H;1-4H,(H,8,9);4*1-5H;12*1-4H.
What are the key properties of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine?
tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 4740.34 g/mol, XLogP of 34.63, 0 rotatable bonds, 4 hydrogen bond donors, and 99 hydrogen bond acceptors.
Where does this data come from?
All data for tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;tris(6H-cyclopenta[c]pyridazine);5H-cyclopenta[d]pyrimidine;furo[2,3-b]pyrazine;furo[2,3-c]pyridazine;furo[3,2-c]pyridazine;furo[2,3-d]pyridazine;furo[2,3-d]pyrimidine;furo[3,2-d]pyrimidine;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;pyrrolo[1,2-a]pyrazine;pyrrolo[1,2-a]pyrimidine;5H-pyrrolo[2,3-b]pyrazine;pyrrolo[1,2-b]pyridazine;7H-pyrrolo[2,3-c]pyridazine;pyrrolo[1,2-c]pyrimidine;1H-pyrrolo[2,3-d]pyridazine;7H-pyrrolo[2,3-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 157241333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).