N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane

C225H246Cl4N42Sn2 — CID 158267536

IUPACN,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane
SMILESC=C(C)[Sn](CCCC)(CCCC)CCCC.C=C(C)c1cc2c(ncn2C)c(N(Cc2ccccc2)Cc2ccccc2)n1.CC(C)c1cc2c(ncn2C)c(N(Cc2ccccc2)Cc2ccccc2)n1.CCCC[Sn](/C=C/c1ccccc1)(CCCC)CCCC.Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C)c2n1.Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C)c2n1.Clc1nc(Cl)c2[nH]cnc2n1.Clc1nc(N(Cc2ccccc2)Cc2ccccc2)c2[nH]cnc2n1.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(/C=C/c3ccccc3)nc21.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(CCc3ccccc3)nc21.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(Cl)nc21
InChIInChI=1S/C28H27N5.C28H25N5.C24H26N4.C24H24N4.2C21H21N5.C20H18ClN5.C19H16ClN5.C8H7.C5H2Cl2N4.6C4H9.C3H5.2Sn/c2*1-32-21-29-26-27(32)30-25(18-17-22-11-5-2-6-12-22)31-28(26)33(19-23-13-7-3-8-14-23)20-24-15-9-4-10-16-24;2*1-18(2)21-14-22-23(25-17-27(22)3)24(26-21)28(15-19-10-6-4-7-11-19)16-20-12-8-5-9-13-20;2*1-16-23-20-19(22-15-25(20)2)21(24-16)26(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18;1-25-14-22-17-18(25)23-20(21)24-19(17)26(12-15-8-4-2-5-9-15)13-16-10-6-3-7-11-16;20-19-23-17-16(21-13-22-17)18(24-19)25(11-14-7-3-1-4-8-14)12-15-9-5-2-6-10-15;1-2-8-6-4-3-5-7-8;6-3-2-4(9-1-8-2)11-5(7)10-3;6*1-3-4-2;1-3-2;;/h2-16,21H,17-20H2,1H3;2-18,21H,19-20H2,1H3;4-14,17-18H,15-16H2,1-3H3;4-14,17H,1,15-16H2,2-3H3;2*3-12,15H,13-14H2,1-2H3;2-11,14H,12-13H2,1H3;1-10,13H,11-12H2,(H,21,22,23,24);1-7H;1H,(H,8,9,10,11);6*1,3-4H2,2H3;1H2,2H3;;/b;18-17+;;;;;;;;;;;;;;;;;
InChIKeyGIQCTWXZZFJGNV-LUBZEKIZSA-N
MW3917.97 g/mol
LogP52.49
Rot. Bonds68

About N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane

N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane (PubChem CID 158267536) has the molecular formula C225H246Cl4N42Sn2 and a molecular weight of 3917.97 g/mol. Its IUPAC name is N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane.

Molecular Properties

Compound NameN,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane
PubChem CID158267536
Molecular FormulaC225H246Cl4N42Sn2
Molecular Weight3917.97 g/mol
Exact Mass3915.73
IUPAC NameN,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane
SMILESC=C(C)[Sn](CCCC)(CCCC)CCCC.C=C(C)c1cc2c(ncn2C)c(N(Cc2ccccc2)Cc2ccccc2)n1.CC(C)c1cc2c(ncn2C)c(N(Cc2ccccc2)Cc2ccccc2)n1.CCCC[Sn](/C=C/c1ccccc1)(CCCC)CCCC.Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C)c2n1.Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C)c2n1.Clc1nc(Cl)c2[nH]cnc2n1.Clc1nc(N(Cc2ccccc2)Cc2ccccc2)c2[nH]cnc2n1.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(/C=C/c3ccccc3)nc21.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(CCc3ccccc3)nc21.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(Cl)nc21
InChIInChI=1S/C28H27N5.C28H25N5.C24H26N4.C24H24N4.2C21H21N5.C20H18ClN5.C19H16ClN5.C8H7.C5H2Cl2N4.6C4H9.C3H5.2Sn/c2*1-32-21-29-26-27(32)30-25(18-17-22-11-5-2-6-12-22)31-28(26)33(19-23-13-7-3-8-14-23)20-24-15-9-4-10-16-24;2*1-18(2)21-14-22-23(25-17-27(22)3)24(26-21)28(15-19-10-6-4-7-11-19)16-20-12-8-5-9-13-20;2*1-16-23-20-19(22-15-25(20)2)21(24-16)26(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18;1-25-14-22-17-18(25)23-20(21)24-19(17)26(12-15-8-4-2-5-9-15)13-16-10-6-3-7-11-16;20-19-23-17-16(21-13-22-17)18(24-19)25(11-14-7-3-1-4-8-14)12-15-9-5-2-6-10-15;1-2-8-6-4-3-5-7-8;6-3-2-4(9-1-8-2)11-5(7)10-3;6*1-3-4-2;1-3-2;;/h2-16,21H,17-20H2,1H3;2-18,21H,19-20H2,1H3;4-14,17-18H,15-16H2,1-3H3;4-14,17H,1,15-16H2,2-3H3;2*3-12,15H,13-14H2,1-2H3;2-11,14H,12-13H2,1H3;1-10,13H,11-12H2,(H,21,22,23,24);1-7H;1H,(H,8,9,10,11);6*1,3-4H2,2H3;1H2,2H3;;/b;18-17+;;;;;;;;;;;;;;;;;
InChIKeyGIQCTWXZZFJGNV-LUBZEKIZSA-N
XLogP52.49
TPSA414.26 Ų
H-Bond Donors2
H-Bond Acceptors40
Rotatable Bonds68
Heavy Atoms273
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003917.97
LogP ≤ 552.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1040

Analyze N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane with MolForge

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Related Compounds

4-amino-6-[[(1S)-1-[3-chloro-6-[3-[6-[[(1R)-1-[3-chloro-6-[3-[6-[[(1S)-1-[3-chloro-6-(2-fluorophenyl)imidazo[1,2-b]pyridazin-7-yl]ethyl]amino]-9H-purin-8-yl]phenyl]imidazo[1,2-b]pyridazin-7-yl]propyl]amino]-9H-purin-8-yl]-5-fluorophenyl]imidazo[1,2-b]pyridazin-7-yl]ethyl]amino]pyrimidine-5-carbonitrile
CID 138602694
N-[(1S)-1-[8-chloro-1-[2-(3,3-difluoroazetidin-1-yl)ethyl]isoquinolin-3-yl]ethyl]-7H-purin-6-amine;N-[(1S)-1-[8-chloro-1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]isoquinolin-3-yl]ethyl]-7H-purin-6-amine;N-[(1S)-1-[8-chloro-1-(2-pyrrolidin-1-ylethyl)isoquinolin-3-yl]ethyl]-7H-purin-6-amine
CID 157594836
1-chloro-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole;1,9-dimethyl-4-[(2S)-1-methylpyrrolidin-2-yl]pyrido[3,4-b]indole;1-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole;9-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]pyrido[2,3-b]indole;3-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[2,3-b]indole;3-[(2S)-1-methylpyrrolidin-2-yl]-4-(trifluoromethyl)-9H-pyrido[2,3-b]indole
CID 157781785
N-[(3-chlorophenyl)methyl]-4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine;N-[(3,4-difluorophenyl)methyl]-4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine;4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-hexylpyrimidin-2-amine;4-[7-ethyl-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-2-amine
CID 158145853
9-benzyl-6-(7,7-diphenylhept-6-enyl)purin-2-amine;6-(7,7-diphenylhept-6-enyl)-9-methyl-2-(trifluoromethyl)purine;6-(7,7-diphenylhept-6-enyl)-2-phenyl-7H-purine;6-(6,6-diphenylhex-5-enyl)-9-methylpurine
CID 158334172
6-(2-ethyl-6-fluoroimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethylimidazo[4,5-c]pyridin-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(2-ethyl-5-methylimidazol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(6-fluoro-2-methylimidazo[4,5-b]pyridin-1-yl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]pyrazin-2-amine;6-(8-methylpurin-7-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
CID 158393714
6-[2-(5-Chloro-2,4-difluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-chlorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine
CID 158403480
3-(6-chloropyrazin-2-yl)-2-methyl-5,6,7,8-tetrahydroindolizine;2,6-dichloropyrazine;2,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;4-methylaniline;2-methylimidazo[1,2-a]pyridine;2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;6-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine
CID 158403718
4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-[(2R,6S)-6-(3-chloro-2-pyridinyl)-1-methylpiperidin-2-yl]-1H-benzimidazole;1-[2-[(2R,6S)-6-(3-chloro-2-pyridinyl)-1-methylpiperidin-2-yl]-1H-benzimidazol-4-yl]-N,N-dimethylpiperidin-4-amine;4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-1H-benzimidazole;4-(3,8-diazabicyclo[3.2.1]octan-8-yl)-2-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-1H-benzimidazole;4-(4-methylpiperazin-1-yl)-2-[(2R,6S)-1-methyl-6-[3-(2,2,2-trifluoroethyl)-2-pyridinyl]piperidin-2-yl]-1H-benzimidazole
CID 159141968
7-(1-Ethylpiperidin-4-yl)-2-(4-fluorophenyl)-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine;3-(2-ethylpyrimidin-4-yl)-2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine;2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)-3-(2-methylpyrimidin-4-yl)imidazo[1,2-a]pyridine;2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)-3-pyrimidin-4-ylimidazo[1,2-a]pyridine;2-(4-fluorophenyl)-7-(1-methylpiperidin-4-yl)-3-[2-(trifluoromethyl)pyrimidin-4-yl]imidazo[1,2-a]pyridine;2-(4-fluorophenyl)-3-(2-methylpyrimidin-4-yl)-7-piperidin-4-ylimidazo[1,2-a]pyridine
CID 159241490
2-[3,5-bis[3-[2-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]phenyl]-3-[2-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridine;3-(2,6-dimethylphenyl)-2-[3-[3-(2,6-dimethylphenyl)-1H-imidazo[4,5-b]pyridin-3-ium-2-yl]-5-[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridine;3-(2,3,4,5,6-pentafluorophenyl)-2-[3-[3-(2,3,4,5,6-pentafluorophenyl)imidazo[4,5-b]pyridin-2-yl]-5-[3-(2,3,4,5,6-pentafluorophenyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]phenyl]imidazo[4,5-b]pyridine
CID 159501331
6-(6-chloro-2-ethylimidazo[4,5-b]pyridin-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;4-chloro-6-(2-methylbenzimidazol-1-yl)-N-[6-(trifluoromethyl)-3-pyridinyl]pyrimidin-2-amine;6-(6-chloro-2-methylimidazo[4,5-b]pyridin-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(4,6-difluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-[2-(difluoromethyl)-6-fluorobenzimidazol-1-yl]-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(4-fluoro-2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 160544143

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane?
The IUPAC name of N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane (CID 158267536) is N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane.
What is the SMILES notation for N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane?
The canonical SMILES for N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane is C=C(C)[Sn](CCCC)(CCCC)CCCC.C=C(C)c1cc2c(ncn2C)c(N(Cc2ccccc2)Cc2ccccc2)n1.CC(C)c1cc2c(ncn2C)c(N(Cc2ccccc2)Cc2ccccc2)n1.CCCC[Sn](/C=C/c1ccccc1)(CCCC)CCCC.Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C)c2n1.Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c2ncn(C)c2n1.Clc1nc(Cl)c2[nH]cnc2n1.Clc1nc(N(Cc2ccccc2)Cc2ccccc2)c2[nH]cnc2n1.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(/C=C/c3ccccc3)nc21.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(CCc3ccccc3)nc21.Cn1cnc2c(N(Cc3ccccc3)Cc3ccccc3)nc(Cl)nc21.
What is the InChIKey of N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane?
The InChIKey is GIQCTWXZZFJGNV-LUBZEKIZSA-N. The full InChI is InChI=1S/C28H27N5.C28H25N5.C24H26N4.C24H24N4.2C21H21N5.C20H18ClN5.C19H16ClN5.C8H7.C5H2Cl2N4.6C4H9.C3H5.2Sn/c2*1-32-21-29-26-27(32)30-25(18-17-22-11-5-2-6-12-22)31-28(26)33(19-23-13-7-3-8-14-23)20-24-15-9-4-10-16-24;2*1-18(2)21-14-22-23(25-17-27(22)3)24(26-21)28(15-19-10-6-4-7-11-19)16-20-12-8-5-9-13-20;2*1-16-23-20-19(22-15-25(20)2)21(24-16)26(13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18;1-25-14-22-17-18(25)23-20(21)24-19(17)26(12-15-8-4-2-5-9-15)13-16-10-6-3-7-11-16;20-19-23-17-16(21-13-22-17)18(24-19)25(11-14-7-3-1-4-8-14)12-15-9-5-2-6-10-15;1-2-8-6-4-3-5-7-8;6-3-2-4(9-1-8-2)11-5(7)10-3;6*1-3-4-2;1-3-2;;/h2-16,21H,17-20H2,1H3;2-18,21H,19-20H2,1H3;4-14,17-18H,15-16H2,1-3H3;4-14,17H,1,15-16H2,2-3H3;2*3-12,15H,13-14H2,1-2H3;2-11,14H,12-13H2,1H3;1-10,13H,11-12H2,(H,21,22,23,24);1-7H;1H,(H,8,9,10,11);6*1,3-4H2,2H3;1H2,2H3;;/b;18-17+;;;;;;;;;;;;;;;;;.
What are the key properties of N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane?
N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane has a molecular weight of 3917.97 g/mol, XLogP of 52.49, 68 rotatable bonds, 2 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-2-chloro-9-methylpurin-6-amine;N,N-dibenzyl-2-chloro-7H-purin-6-amine;bis(N,N-dibenzyl-2,9-dimethylpurin-6-amine);N,N-dibenzyl-9-methyl-2-[(E)-2-phenylethenyl]purin-6-amine;N,N-dibenzyl-9-methyl-2-(2-phenylethyl)purin-6-amine;N,N-dibenzyl-1-methyl-6-propan-2-ylimidazo[4,5-c]pyridin-4-amine;N,N-dibenzyl-1-methyl-6-prop-1-en-2-ylimidazo[4,5-c]pyridin-4-amine;2,6-dichloro-7H-purine;tributyl-[(E)-2-phenylethenyl]stannane;tributyl(prop-1-en-2-yl)stannane is sourced from PubChem (CID 158267536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).