benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole

C284H186N36S8 — CID 159394789

IUPACbenzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole
SMILESC1=c2sc(-c3ccccc3)nc2=C(c2cccc3ccccc23)CC1c1nc(-c2ccccc2)nc(-c2ccccc2)n1.C1=c2sc(-c3ccccc3)nc2=C(c2cccnc2)CC1c1nc(-c2ccccc2)nc(-c2ccccc2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc5ccccc45)c4sc(-c5ccccc5)nc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc5ccccc45)cc4sc(-c5ccccc5)nc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccnc4)cc4sc(-c5ccccc5)nc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5ccccc45)c4nc(-c5ccccc5)sc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccnc4)c4nc(-c5ccccc5)sc34)n2)cc1.c1ccc(-c2nc(-c3cccnc3)nc(-c3cc(-c4ccccc4)c4scnc4c3)n2)cc1.c1ccccc1
InChIInChI=1S/C38H26N4S.3C38H24N4S.C33H21N5S.C33H23N5S.C33H21N5S.C27H17N5S.C6H6/c1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)29-23-32(31-22-12-20-25-13-10-11-21-30(25)31)34-33(24-29)43-38(39-34)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)29-23-32(31-22-12-20-25-13-10-11-21-30(25)31)34-33(24-29)39-38(43-34)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)32-23-29(31-22-12-20-25-13-10-11-21-30(25)31)24-33-34(32)39-38(43-33)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)32-24-23-31(30-22-12-20-25-13-10-11-21-29(25)30)33-34(32)43-38(39-33)28-18-8-3-9-19-28;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)27-19-18-26(25-17-10-20-34-21-25)28-29(27)39-33(35-28)24-15-8-3-9-16-24;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)26-19-27(25-17-10-18-34-21-25)29-28(20-26)39-33(35-29)24-15-8-3-9-16-24;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)27-19-26(25-17-10-18-34-21-25)20-28-29(27)35-33(39-28)24-15-8-3-9-16-24;1-3-8-18(9-4-1)22-14-21(15-23-24(22)33-17-29-23)27-31-25(19-10-5-2-6-11-19)30-26(32-27)20-12-7-13-28-16-20;1-2-4-6-5-3-1/h1-22,24,29H,23H2;3*1-24H;1-21H;1-18,20-21,26H,19H2;1-21H;1-17H;1-6H
InChIKeyLMOOMMAYSBTSMC-UHFFFAOYSA-N
MW4359.40 g/mol
LogP68.10
Rot. Bonds39

About benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole

benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole (PubChem CID 159394789) has the molecular formula C284H186N36S8 and a molecular weight of 4359.40 g/mol. Its IUPAC name is benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole.

Molecular Properties

Compound Namebenzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole
PubChem CID159394789
Molecular FormulaC284H186N36S8
Molecular Weight4359.40 g/mol
Exact Mass4355.34
IUPAC Namebenzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole
SMILESC1=c2sc(-c3ccccc3)nc2=C(c2cccc3ccccc23)CC1c1nc(-c2ccccc2)nc(-c2ccccc2)n1.C1=c2sc(-c3ccccc3)nc2=C(c2cccnc2)CC1c1nc(-c2ccccc2)nc(-c2ccccc2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc5ccccc45)c4sc(-c5ccccc5)nc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc5ccccc45)cc4sc(-c5ccccc5)nc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccnc4)cc4sc(-c5ccccc5)nc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5ccccc45)c4nc(-c5ccccc5)sc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccnc4)c4nc(-c5ccccc5)sc34)n2)cc1.c1ccc(-c2nc(-c3cccnc3)nc(-c3cc(-c4ccccc4)c4scnc4c3)n2)cc1.c1ccccc1
InChIInChI=1S/C38H26N4S.3C38H24N4S.C33H21N5S.C33H23N5S.C33H21N5S.C27H17N5S.C6H6/c1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)29-23-32(31-22-12-20-25-13-10-11-21-30(25)31)34-33(24-29)43-38(39-34)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)29-23-32(31-22-12-20-25-13-10-11-21-30(25)31)34-33(24-29)39-38(43-34)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)32-23-29(31-22-12-20-25-13-10-11-21-30(25)31)24-33-34(32)39-38(43-33)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)32-24-23-31(30-22-12-20-25-13-10-11-21-29(25)30)33-34(32)43-38(39-33)28-18-8-3-9-19-28;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)27-19-18-26(25-17-10-20-34-21-25)28-29(27)39-33(35-28)24-15-8-3-9-16-24;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)26-19-27(25-17-10-18-34-21-25)29-28(20-26)39-33(35-29)24-15-8-3-9-16-24;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)27-19-26(25-17-10-18-34-21-25)20-28-29(27)35-33(39-28)24-15-8-3-9-16-24;1-3-8-18(9-4-1)22-14-21(15-23-24(22)33-17-29-23)27-31-25(19-10-5-2-6-11-19)30-26(32-27)20-12-7-13-28-16-20;1-2-4-6-5-3-1/h1-22,24,29H,23H2;3*1-24H;1-21H;1-18,20-21,26H,19H2;1-21H;1-17H;1-6H
InChIKeyLMOOMMAYSBTSMC-UHFFFAOYSA-N
XLogP68.10
TPSA464.04 Ų
H-Bond Donors
H-Bond Acceptors44
Rotatable Bonds39
Heavy Atoms328
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004359.40
LogP ≤ 568.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1044

Analyze benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole with MolForge

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Related Compounds

2-[1-(4-Tert-butyl-1-methylnaphthalen-2-yl)-2-methylisoquinolin-2-ium-6-yl]-4-methyl-1,3-thiazole;7-(4-tert-butyl-1-methylnaphthalen-2-yl)-6-methyl-3-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-c]pyridin-6-ium;4-(4-tert-butyl-1-methylnaphthalen-2-yl)-3-methyl-7-(4-methyl-1,3-thiazol-2-yl)thieno[3,2-d]pyrimidin-3-ium;2-[6-(4-tert-butyl-1-methylnaphthalen-2-yl)-1-methylpyrimidin-1-ium-4-yl]-4-methyl-1,3-thiazole;2-[6-(4-tert-butyl-1-methylnaphthalen-2-yl)-1-methylpyrimidin-1-ium-4-yl]-4-(3,3,3-trifluoro-2,2-dimethylpropyl)-1,3-thiazole;2-[2-(4-tert-butyl-1-methylnaphthalen-2-yl)-1-methylquinolin-1-ium-4-yl]-4-methyl-1,3-thiazole
CID 160970041
2-[3-Benzo[h]isoquinolin-5-yl-5-[3-[5-[3,5-bis(trifluoromethyl)phenyl]-4-phenyl-1,2,4-triazol-3-yl]phenyl]phenyl]-1,3-benzothiazole;2-(3,5-dipyridin-3-ylphenyl)-1,3-benzothiazole;2-[3-(3,5-dipyridin-3-ylphenyl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole;2-[3-pyridin-3-yl-5-(3-pyridin-3-ylphenyl)phenyl]-1,3-benzothiazole
CID 161244750
CID 161910738
CID 161910738
9,10-bis(1,3-benzothiazol-2-yl)-2-N,2-N,7-N,7-N-tetrapyridin-2-ylanthracene-2,7-diamine
CID 57909583
8-[4,6-Bis[6-(3-pyrido[3,2-b]indol-5-ylphenyl)dibenzothiophen-2-yl]-1,3,5-triazin-2-yl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58058978
4-[3-[4,6-Bis[3-[8-[8-(3-pyrimidin-4-yl-2-pyridinyl)pyrido[4,3-b]indol-5-yl]dibenzothiophen-2-yl]phenyl]dibenzothiophen-2-yl]phenyl]-12-(3-pyrimidin-4-yl-2-pyridinyl)-8-thia-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58099619
8-[6-[6-[5-[2,3,7-Trimethyl-1,9-diphenyl-6-[8-[6-[6-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indol-5-yl]dibenzothiophen-4-yl]pyrido[3,2-b]indol-8-yl]-2-pyridinyl]-2-pyridinyl]-4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 58099641
3-[3-(1,3,5-Triazin-2-yl)pyrazin-2-yl]-9-[8-[4-[6-[4-[8-[3-[3-(1,3,5-triazin-2-yl)pyrazin-2-yl]carbazol-9-yl]dibenzothiophen-2-yl]-1,3,5-triazin-2-yl]-2-[4-[8-[3-(1,3,5-triazin-2-yl)pyrazin-2-yl]dibenzothiophen-2-yl]-1,3,5-triazin-2-yl]dibenzothiophen-4-yl]-1,3,5-triazin-2-yl]dibenzothiophen-2-yl]carbazole
CID 58099746
2-[9,10,12,21,22,23,24-Heptakis([1,3]thiazolo[4,5-b]pyridin-2-yl)-3,15-diazapentacyclo[18.4.0.02,7.08,13.014,19]tetracosa-1(20),2(7),3,5,8(13),9,11,14(19),15,17,21,23-dodecaen-11-yl]-[1,3]thiazolo[4,5-b]pyridine
CID 58978768
2-[3-([1,3]Thiazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]thiazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]thiazolo[4,5-b]pyrazine
CID 59866418
2-[4-[12-[4,6-Di(isoquinolin-1-yl)-1,3,5-triazin-2-yl]-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-20-yl]phenyl]-1,3-benzothiazole
CID 71277881
7,8-Dimethyl-9,12-diphenyl-17-[6-[6-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-2-pyridinyl]-2-pyridinyl]-6-[8-[6-[6-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indol-5-yl]-4-thia-1,21-diazaheptacyclo[13.10.1.02,14.03,11.05,10.019,26.020,25]hexacosa-2,5,7,9,11,13,15(26),16,18,20(25),21,23-dodecaene
CID 88985959

Frequently Asked Questions

What is the IUPAC name of benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole?
The IUPAC name of benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole (CID 159394789) is benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole.
What is the SMILES notation for benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole?
The canonical SMILES for benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole is C1=c2sc(-c3ccccc3)nc2=C(c2cccc3ccccc23)CC1c1nc(-c2ccccc2)nc(-c2ccccc2)n1.C1=c2sc(-c3ccccc3)nc2=C(c2cccnc2)CC1c1nc(-c2ccccc2)nc(-c2ccccc2)n1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc5ccccc45)c4sc(-c5ccccc5)nc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccc5ccccc45)cc4sc(-c5ccccc5)nc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4cccnc4)cc4sc(-c5ccccc5)nc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5ccccc45)c4nc(-c5ccccc5)sc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccnc4)c4nc(-c5ccccc5)sc34)n2)cc1.c1ccc(-c2nc(-c3cccnc3)nc(-c3cc(-c4ccccc4)c4scnc4c3)n2)cc1.c1ccccc1.
What is the InChIKey of benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole?
The InChIKey is LMOOMMAYSBTSMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26N4S.3C38H24N4S.C33H21N5S.C33H23N5S.C33H21N5S.C27H17N5S.C6H6/c1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)29-23-32(31-22-12-20-25-13-10-11-21-30(25)31)34-33(24-29)43-38(39-34)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)29-23-32(31-22-12-20-25-13-10-11-21-30(25)31)34-33(24-29)39-38(43-34)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)32-23-29(31-22-12-20-25-13-10-11-21-30(25)31)24-33-34(32)39-38(43-33)28-18-8-3-9-19-28;1-4-14-26(15-5-1)35-40-36(27-16-6-2-7-17-27)42-37(41-35)32-24-23-31(30-22-12-20-25-13-10-11-21-29(25)30)33-34(32)43-38(39-33)28-18-8-3-9-19-28;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)27-19-18-26(25-17-10-20-34-21-25)28-29(27)39-33(35-28)24-15-8-3-9-16-24;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)26-19-27(25-17-10-18-34-21-25)29-28(20-26)39-33(35-29)24-15-8-3-9-16-24;1-4-11-22(12-5-1)30-36-31(23-13-6-2-7-14-23)38-32(37-30)27-19-26(25-17-10-18-34-21-25)20-28-29(27)35-33(39-28)24-15-8-3-9-16-24;1-3-8-18(9-4-1)22-14-21(15-23-24(22)33-17-29-23)27-31-25(19-10-5-2-6-11-19)30-26(32-27)20-12-7-13-28-16-20;1-2-4-6-5-3-1/h1-22,24,29H,23H2;3*1-24H;1-21H;1-18,20-21,26H,19H2;1-21H;1-17H;1-6H.
What are the key properties of benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole?
benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole has a molecular weight of 4359.40 g/mol, XLogP of 68.10, 39 rotatable bonds, 0 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-naphthalen-1-yl-2-phenyl-5,6-dihydro-1,3-benzothiazole;4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-6-pyridin-3-yl-1,3-benzothiazole;7-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-1,3-benzothiazole;6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-phenyl-4-pyridin-3-yl-5,6-dihydro-1,3-benzothiazole;7-phenyl-5-(4-phenyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)-1,3-benzothiazole is sourced from PubChem (CID 159394789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).