About 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile
10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile (PubChem CID 159891955) has the molecular formula C169H128N18OS3
and a molecular weight of 2523.21 g/mol. Its IUPAC name is 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile.
Frequently Asked Questions
What is the IUPAC name of 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile?
The IUPAC name of 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile (CID 159891955) is 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile.
What is the SMILES notation for 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile?
The canonical SMILES for 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile is CC1(C)c2cccc3c2N2c4c1cccc4C(C)(C)c1cc(-c4nc5cnccc5n4-c4ccc(C#N)cc4)cc(c12)C3(C)C.CC1(C)c2cccc3c2N2c4c1cccc4C(C)(C)c1cc(-c4nc5ncccc5n4-c4ccc(C#N)cc4)cc(c12)C3(C)C.CC1(C)c2ccccc2N(c2ccc(-c3nc4cccnc4s3)cc2)c2ccccc21.c1ccc(C2(c3ccccc3)c3ccccc3N(c3ccc(-c4nc5cccnc5s4)cc3)c3ccccc32)cc1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ccccc3s2)cc1.
What is the InChIKey of 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile?
The InChIKey is NUWBQFXFWIUCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C40H33N5.C37H25N3S.C27H21N3S.C25H16N2OS/c1-38(2)26-10-7-12-28-33(26)45-34-27(38)11-8-13-29(34)40(5,6)31-21-24(20-30(35(31)45)39(28,3)4)37-43-36-32(14-9-19-42-36)44(37)25-17-15-23(22-41)16-18-25;1-38(2)26-9-7-11-28-34(26)45-35-27(38)10-8-12-29(35)40(5,6)31-20-24(19-30(36(31)45)39(28,3)4)37-43-32-22-42-18-17-33(32)44(37)25-15-13-23(21-41)14-16-25;1-3-12-27(13-4-1)37(28-14-5-2-6-15-28)30-16-7-9-19-33(30)40(34-20-10-8-17-31(34)37)29-23-21-26(22-24-29)35-39-32-18-11-25-38-36(32)41-35;1-27(2)20-8-3-5-11-23(20)30(24-12-6-4-9-21(24)27)19-15-13-18(14-16-19)25-29-22-10-7-17-28-26(22)31-25;1-6-12-24-19(7-1)26-25(29-24)17-13-15-18(16-14-17)27-20-8-2-4-10-22(20)28-23-11-5-3-9-21(23)27/h7-21H,1-6H3;7-20,22H,1-6H3;1-25H;3-17H,1-2H3;1-16H.
What are the key properties of 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile?
10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile has a molecular weight of 2523.21 g/mol, XLogP of 43.22, 12 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-(1,3-benzothiazol-2-yl)phenyl]phenoxazine;2-[4-(9,9-dimethylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;2-[4-(9,9-diphenylacridin-10-yl)phenyl]-[1,3]thiazolo[5,4-b]pyridine;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-b]pyridin-1-yl]benzonitrile;4-[2-(8,8,14,14,22,22-hexamethyl-1-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15(20),16,18-nonaen-5-yl)imidazo[4,5-c]pyridin-1-yl]benzonitrile is sourced from PubChem (CID 159891955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).