1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline

C190H209N17O2 — CID 159109331

IUPAC1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline
SMILESCC(C)(C)N1CCc2ccccc2C1.CC(C)(C)N1c2ccccc2C=Cc2ccccc21.CC(C)(C)c1cc(-c2ccccc2)cc2ccccc12.CC(C)(C)c1cc(-c2ccccn2)nc2c3c(ccc12)OCC3.CC(C)(C)c1ccc2cnccc2c1.CC(C)(C)c1cccc(Oc2ccccc2)c1.CC(C)(C)c1ccnc2ccccc12.CC(C)(C)c1nc(-c2ccccn2)nc2ccccc12.CC(C)(C)c1nc2ccccc2nc1-c1ccccc1.CC(C)(C)c1nccc2ccccc12.CC(C)(C)n1cnc2ccccc21.CC(C)(C)n1nc(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C20H20N2O.C20H20.C18H19N3.C18H18N2.C18H19N.C17H17N3.C16H18O.C13H15N.C13H19N.2C13H15N.C11H14N2/c1-20(2,3)15-12-17(16-6-4-5-10-21-16)22-19-13(15)7-8-18-14(19)9-11-23-18;1-20(2,3)19-14-17(15-9-5-4-6-10-15)13-16-11-7-8-12-18(16)19;1-18(2,3)21-19-16(14-10-6-4-7-11-14)17(20-21)15-12-8-5-9-13-15;1-18(2,3)17-16(13-9-5-4-6-10-13)19-14-11-7-8-12-15(14)20-17;1-18(2,3)19-16-10-6-4-8-14(16)12-13-15-9-5-7-11-17(15)19;1-17(2,3)15-12-8-4-5-9-13(12)19-16(20-15)14-10-6-7-11-18-14;1-16(2,3)13-8-7-11-15(12-13)17-14-9-5-4-6-10-14;1-13(2,3)12-5-4-11-9-14-7-6-10(11)8-12;1-13(2,3)14-9-8-11-6-4-5-7-12(11)10-14;1-13(2,3)11-8-9-14-12-7-5-4-6-10(11)12;1-13(2,3)12-11-7-5-4-6-10(11)8-9-14-12;1-11(2,3)13-8-12-9-6-4-5-7-10(9)13/h4-8,10,12H,9,11H2,1-3H3;4-14H,1-3H3;4-13H,1-3H3;4-12H,1-3H3;4-13H,1-3H3;4-11H,1-3H3;4-12H,1-3H3;4-9H,1-3H3;4-7H,8-10H2,1-3H3;2*4-9H,1-3H3;4-8H,1-3H3
InChIKeyKEHCJBZFDXOMOH-UHFFFAOYSA-N
MW2762.88 g/mol
LogP49.40
Rot. Bonds8

About 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline

1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline (PubChem CID 159109331) has the molecular formula C190H209N17O2 and a molecular weight of 2762.88 g/mol. Its IUPAC name is 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline.

Molecular Properties

Compound Name1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline
PubChem CID159109331
Molecular FormulaC190H209N17O2
Molecular Weight2762.88 g/mol
Exact Mass2760.68
IUPAC Name1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline
SMILESCC(C)(C)N1CCc2ccccc2C1.CC(C)(C)N1c2ccccc2C=Cc2ccccc21.CC(C)(C)c1cc(-c2ccccc2)cc2ccccc12.CC(C)(C)c1cc(-c2ccccn2)nc2c3c(ccc12)OCC3.CC(C)(C)c1ccc2cnccc2c1.CC(C)(C)c1cccc(Oc2ccccc2)c1.CC(C)(C)c1ccnc2ccccc12.CC(C)(C)c1nc(-c2ccccn2)nc2ccccc12.CC(C)(C)c1nc2ccccc2nc1-c1ccccc1.CC(C)(C)c1nccc2ccccc12.CC(C)(C)n1cnc2ccccc21.CC(C)(C)n1nc(-c2ccccc2)c(-c2ccccc2)n1
InChIInChI=1S/C20H20N2O.C20H20.C18H19N3.C18H18N2.C18H19N.C17H17N3.C16H18O.C13H15N.C13H19N.2C13H15N.C11H14N2/c1-20(2,3)15-12-17(16-6-4-5-10-21-16)22-19-13(15)7-8-18-14(19)9-11-23-18;1-20(2,3)19-14-17(15-9-5-4-6-10-15)13-16-11-7-8-12-18(16)19;1-18(2,3)21-19-16(14-10-6-4-7-11-14)17(20-21)15-12-8-5-9-13-15;1-18(2,3)17-16(13-9-5-4-6-10-13)19-14-11-7-8-12-15(14)20-17;1-18(2,3)19-16-10-6-4-8-14(16)12-13-15-9-5-7-11-17(15)19;1-17(2,3)15-12-8-4-5-9-13(12)19-16(20-15)14-10-6-7-11-18-14;1-16(2,3)13-8-7-11-15(12-13)17-14-9-5-4-6-10-14;1-13(2,3)12-5-4-11-9-14-7-6-10(11)8-12;1-13(2,3)14-9-8-11-6-4-5-7-12(11)10-14;1-13(2,3)11-8-9-14-12-7-5-4-6-10(11)12;1-13(2,3)12-11-7-5-4-6-10(11)8-9-14-12;1-11(2,3)13-8-12-9-6-4-5-7-10(9)13/h4-8,10,12H,9,11H2,1-3H3;4-14H,1-3H3;4-13H,1-3H3;4-12H,1-3H3;4-13H,1-3H3;4-11H,1-3H3;4-12H,1-3H3;4-9H,1-3H3;4-7H,8-10H2,1-3H3;2*4-9H,1-3H3;4-8H,1-3H3
InChIKeyKEHCJBZFDXOMOH-UHFFFAOYSA-N
XLogP49.40
TPSA202.37 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds8
Heavy Atoms209
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002762.88
LogP ≤ 549.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-tert-butyl-2,3-dihydro-1,4-benzodioxine;2-tert-butyl-1,3-dihydroisoindole;2-tert-butyl-3,4-dihydro-1H-isoquinoline
CID 162153943
4-tert-butyl-2-naphthalen-1-ylquinazoline;4-tert-butyl-2-naphthalen-2-ylquinazoline;4-tert-butyl-2-phenanthren-2-ylquinazoline;4-tert-butyl-2-phenanthren-3-ylquinazoline;4-tert-butyl-2-(3-phenylphenyl)quinazoline;4-tert-butyl-2-(4-phenylphenyl)quinazoline
CID 161364609
4-tert-butyl-3,4-dihydro-2H-chromene;1-tert-butyl-2,3-dihydro-1H-indene;1-tert-butyl-2,3-dihydroindole;4-tert-butyl-1-methyl-3,4-dihydro-2H-quinoline;5-tert-butyl-6-methylquinoline;1-tert-butylnaphthalene;6-tert-butylquinoline;8-tert-butylquinoline;1-tert-butyl-1,2,3,4-tetrahydronaphthalene;2-tert-butyl-1,2,3,4-tetrahydronaphthalene;(2,2-dimethyl-1-phenylpropyl)benzene;1-methylindole
CID 165006244
4-tert-butyl-8-fluoroquinoline;1-tert-butylisoquinoline;2-tert-butylquinoline;3-tert-butylquinoline;4-tert-butylquinoline;5-tert-butylquinoline;6-tert-butylquinoline;8-tert-butylquinoline;5-tert-butylquinoxaline;4-propan-2-ylisoquinoline;5-propan-2-ylisoquinoline
CID 167610785
18-[3-(9,9-dimethylfluoren-2-yl)phenyl]pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene;2-(9-hexacyclo[16.8.0.02,11.03,8.012,17.020,25]hexacosa-1(26),2(11),3,5,7,9,12,14,16,18,20,22,24-tridecaenyl)benzo[h]quinoline;2-(9-hexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12,14,16,19,21,23,25-tridecaenyl)benzo[h]quinoline;6-(9-hexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12,14,16,19,21,23,25-tridecaenyl)isoquinoline;2-(9-hexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12,14,16,19,21,23,25-tridecaenyl)pyrimidine;6-(9-hexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12,14,16,19,21,23,25-tridecaenyl)quinoxaline;2-(9-hexacyclo[16.8.0.02,11.03,8.012,17.021,26]hexacosa-1(18),2(11),3,5,7,9,12,14,16,19,21,23,25-tridecaenyl)-1,3,5-triazine;3-(3-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaen-18-ylphenyl)-9-phenylcarbazole;18-phenylpentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene;18-(4-phenylphenyl)pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8(20),9,11,13,15,17-decaene
CID 157230673
2-chrysen-2-ylbenzo[h]quinoline;2-(6-chrysen-2-ylisoquinolin-8-yl)-1,10-phenanthroline;6-chrysen-2-yl-1-methylbenzimidazole;7-chrysen-2-yl-1-methylbenzimidazole;3-(4-chrysen-2-ylnaphthalen-1-yl)-1,10-phenanthroline;6-(3-chrysen-2-ylphenyl)isoquinoline;2-chrysen-2-ylpyridine;bis(7-(2-chrysen-2-yl-4-pyridinyl)quinoline);2-chrysen-2-ylpyrimidine;2-(2-chrysen-2-ylpyrimidin-4-yl)-1,10-phenanthroline;2-chrysen-2-yl-1,3,5-triazine;2-(4-chrysen-2-yl-1,3,5-triazin-2-yl)-1,10-phenanthroline
CID 158201598
N-[4-[3-[4-(4-carbazol-9-yl-N-isoquinolin-7-ylanilino)phenyl]quinoxalin-2-yl]phenyl]-N-(4-carbazol-9-ylphenyl)isoquinolin-7-amine;N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-N-(6-phenyl-3-pyridinyl)anilino)phenyl]quinoxalin-2-yl]phenyl]-6-phenylpyridin-3-amine;N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-N-(6-pyridin-2-yl-3-pyridinyl)anilino)phenyl]quinoxalin-2-yl]phenyl]-6-pyridin-2-ylpyridin-3-amine;N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-N-(6-pyridin-3-yl-3-pyridinyl)anilino)phenyl]quinoxalin-2-yl]phenyl]-6-pyridin-3-ylpyridin-3-amine;N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-N-(6-pyridin-4-yl-3-pyridinyl)anilino)phenyl]quinoxalin-2-yl]phenyl]-6-pyridin-4-ylpyridin-3-amine;N-(4-carbazol-9-ylphenyl)-N-[4-[3-[4-(4-carbazol-9-yl-N-quinolin-7-ylanilino)phenyl]quinoxalin-2-yl]phenyl]quinolin-7-amine
CID 162155862
2-tert-butyl-4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazine;2-tert-butyl-4,6-diphenylpyridine;3-tert-butyl-9-naphthalen-2-ylcarbazole;2-tert-butyl-4-naphthalen-2-ylquinazoline;1-tert-butyl-4-phenylnaphthalene;2-(4-tert-butylphenyl)pyridine
CID 159081054
2,6-dipyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;2-pyridin-2-yl-4-(2,3,4-tritert-butylphenyl)pyridine;bis(1,2,3-tritert-butyl-4-phenylbenzene);5-(2,3,4-tritert-butylphenyl)-1,10-phenanthroline;3-(3,4,5-tritert-butylphenyl)pyridine
CID 159772988
5-[3-(2-phenanthren-2-yl-6-pyridin-2-yl-4-pyridinyl)phenyl]pyrido[4,3-b]indole
CID 59326078
6-tert-butyl-16-(2,3-diphenylimidazo[1,2-f]phenanthridin-11-yl)oxy-1,3-diazapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13(18),14,16-nonaene
CID 163966434
9-(4-tert-butyl-2-pyridinyl)-2-[3-(3-phenanthren-2-yl-2H-benzimidazol-1-yl)phenoxy]carbazole
CID 176782620

Frequently Asked Questions

What is the IUPAC name of 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline?
The IUPAC name of 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline (CID 159109331) is 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline.
What is the SMILES notation for 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline?
The canonical SMILES for 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline is CC(C)(C)N1CCc2ccccc2C1.CC(C)(C)N1c2ccccc2C=Cc2ccccc21.CC(C)(C)c1cc(-c2ccccc2)cc2ccccc12.CC(C)(C)c1cc(-c2ccccn2)nc2c3c(ccc12)OCC3.CC(C)(C)c1ccc2cnccc2c1.CC(C)(C)c1cccc(Oc2ccccc2)c1.CC(C)(C)c1ccnc2ccccc12.CC(C)(C)c1nc(-c2ccccn2)nc2ccccc12.CC(C)(C)c1nc2ccccc2nc1-c1ccccc1.CC(C)(C)c1nccc2ccccc12.CC(C)(C)n1cnc2ccccc21.CC(C)(C)n1nc(-c2ccccc2)c(-c2ccccc2)n1.
What is the InChIKey of 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline?
The InChIKey is KEHCJBZFDXOMOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O.C20H20.C18H19N3.C18H18N2.C18H19N.C17H17N3.C16H18O.C13H15N.C13H19N.2C13H15N.C11H14N2/c1-20(2,3)15-12-17(16-6-4-5-10-21-16)22-19-13(15)7-8-18-14(19)9-11-23-18;1-20(2,3)19-14-17(15-9-5-4-6-10-15)13-16-11-7-8-12-18(16)19;1-18(2,3)21-19-16(14-10-6-4-7-11-14)17(20-21)15-12-8-5-9-13-15;1-18(2,3)17-16(13-9-5-4-6-10-13)19-14-11-7-8-12-15(14)20-17;1-18(2,3)19-16-10-6-4-8-14(16)12-13-15-9-5-7-11-17(15)19;1-17(2,3)15-12-8-4-5-9-13(12)19-16(20-15)14-10-6-7-11-18-14;1-16(2,3)13-8-7-11-15(12-13)17-14-9-5-4-6-10-14;1-13(2,3)12-5-4-11-9-14-7-6-10(11)8-12;1-13(2,3)14-9-8-11-6-4-5-7-12(11)10-14;1-13(2,3)11-8-9-14-12-7-5-4-6-10(11)12;1-13(2,3)12-11-7-5-4-6-10(11)8-9-14-12;1-11(2,3)13-8-12-9-6-4-5-7-10(9)13/h4-8,10,12H,9,11H2,1-3H3;4-14H,1-3H3;4-13H,1-3H3;4-12H,1-3H3;4-13H,1-3H3;4-11H,1-3H3;4-12H,1-3H3;4-9H,1-3H3;4-7H,8-10H2,1-3H3;2*4-9H,1-3H3;4-8H,1-3H3.
What are the key properties of 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline?
1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline has a molecular weight of 2762.88 g/mol, XLogP of 49.40, 8 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butylbenzimidazole;11-tert-butylbenzo[b][1]benzazepine;2-tert-butyl-3,4-dihydro-1H-isoquinoline;2-tert-butyl-4,5-diphenyltriazole;1-tert-butylisoquinoline;6-tert-butylisoquinoline;1-tert-butyl-3-phenoxybenzene;1-tert-butyl-3-phenylnaphthalene;2-tert-butyl-3-phenylquinoxaline;4-tert-butyl-2-pyridin-2-yl-8,9-dihydrofuro[2,3-h]quinoline;4-tert-butyl-2-pyridin-2-ylquinazoline;4-tert-butylquinoline is sourced from PubChem (CID 159109331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).