[(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)

C257H289Cl16F3N18SSi8Ti8-16 — CID 162272741

IUPAC[(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)
SMILESCC1=C(c2ccccc2)[C@H]2C[C@@H](C)C([Si](C)(C)N3c4ccccc4[N-]c4ccccc43)[C@H]2S1.CC[C@@H]1C[C@@H]2C(c3ccccc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(C3CCCCC3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccc(C(F)(F)F)cc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccc(N(C)C)cc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3cccc(-c4ccccc4)c3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccccc3)=CC=N[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@H]2[C@H](C=CC=C[C@H]2c2ccccc2)C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C36H35N2Si.C32H36N3Si.C31H30F3N2Si.2C31H33N2Si.C30H37N2Si.C29H30N3Si.C29H31N2SSi.8CH3.16ClH.8Ti/c1-25-23-31-29(28-16-11-15-27(24-28)26-13-5-4-6-14-26)17-12-18-30(31)36(25)39(2,3)38-34-21-9-7-19-32(34)37-33-20-8-10-22-35(33)38;1-22-21-27-25(23-17-19-24(20-18-23)34(2)3)11-10-12-26(27)32(22)36(4,5)35-30-15-8-6-13-28(30)33-29-14-7-9-16-31(29)35;1-20-19-25-23(21-15-17-22(18-16-21)31(32,33)34)9-8-10-24(25)30(20)37(2,3)36-28-13-6-4-11-26(28)35-27-12-5-7-14-29(27)36;1-22-21-26-24(23-13-5-4-6-14-23)15-7-8-16-25(26)31(22)34(2,3)33-29-19-11-9-17-27(29)32-28-18-10-12-20-30(28)33;1-4-22-21-26-24(23-13-6-5-7-14-23)15-12-16-25(26)31(22)34(2,3)33-29-19-10-8-17-27(29)32-28-18-9-11-20-30(28)33;1-21-20-25-23(22-12-5-4-6-13-22)14-11-15-24(25)30(21)33(2,3)32-28-18-9-7-16-26(28)31-27-17-8-10-19-29(27)32;1-20-19-23-22(21-11-5-4-6-12-21)17-18-30-28(23)29(20)33(2,3)32-26-15-9-7-13-24(26)31-25-14-8-10-16-27(25)32;1-19-18-22-27(21-12-6-5-7-13-21)20(2)32-28(22)29(19)33(3,4)31-25-16-10-8-14-23(25)30-24-15-9-11-17-26(24)31;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-22,24-25,30-31,36H,23H2,1-3H3;6-20,22,26-27,32H,21H2,1-5H3;4-18,20,24-25,30H,19H2,1-3H3;4-20,22,24-26,31H,21H2,1-3H3;5-20,22,25-26,31H,4,21H2,1-3H3;7-11,14-19,21-22,24-25,30H,4-6,12-13,20H2,1-3H3;4-18,20,23,28-29H,19H2,1-3H3;5-17,19,22,28-29H,18H2,1-4H3;8*1H3;16*1H;;;;;;;;/q16*-1;;;;;;;;;;;;;;;;;8*+2/p-16/t25-,30+,31-,36?;22-,26+,27-,32?;20-,24+,25-,30?;22-,24+,25+,26-,31?;22-,25+,26-,31?;21-,24+,25-,30?;20-,23-,28+,29?;19-,22-,28+,29?;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/m11111111................................/s1
InChIKeyAYYXBSHKWHLFNV-UCYWPSHOSA-A
MW4894.20 g/mol
LogP89.79
Rot. Bonds27

About [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)

[(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium) (PubChem CID 162272741) has the molecular formula C257H289Cl16F3N18SSi8Ti8-16 and a molecular weight of 4894.20 g/mol. Its IUPAC name is [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium).

Molecular Properties

Compound Name[(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)
PubChem CID162272741
Molecular FormulaC257H289Cl16F3N18SSi8Ti8-16
Molecular Weight4894.20 g/mol
Exact Mass4883.19
IUPAC Name[(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)
SMILESCC1=C(c2ccccc2)[C@H]2C[C@@H](C)C([Si](C)(C)N3c4ccccc4[N-]c4ccccc43)[C@H]2S1.CC[C@@H]1C[C@@H]2C(c3ccccc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(C3CCCCC3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccc(C(F)(F)F)cc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccc(N(C)C)cc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3cccc(-c4ccccc4)c3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccccc3)=CC=N[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@H]2[C@H](C=CC=C[C@H]2c2ccccc2)C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C36H35N2Si.C32H36N3Si.C31H30F3N2Si.2C31H33N2Si.C30H37N2Si.C29H30N3Si.C29H31N2SSi.8CH3.16ClH.8Ti/c1-25-23-31-29(28-16-11-15-27(24-28)26-13-5-4-6-14-26)17-12-18-30(31)36(25)39(2,3)38-34-21-9-7-19-32(34)37-33-20-8-10-22-35(33)38;1-22-21-27-25(23-17-19-24(20-18-23)34(2)3)11-10-12-26(27)32(22)36(4,5)35-30-15-8-6-13-28(30)33-29-14-7-9-16-31(29)35;1-20-19-25-23(21-15-17-22(18-16-21)31(32,33)34)9-8-10-24(25)30(20)37(2,3)36-28-13-6-4-11-26(28)35-27-12-5-7-14-29(27)36;1-22-21-26-24(23-13-5-4-6-14-23)15-7-8-16-25(26)31(22)34(2,3)33-29-19-11-9-17-27(29)32-28-18-10-12-20-30(28)33;1-4-22-21-26-24(23-13-6-5-7-14-23)15-12-16-25(26)31(22)34(2,3)33-29-19-10-8-17-27(29)32-28-18-9-11-20-30(28)33;1-21-20-25-23(22-12-5-4-6-13-22)14-11-15-24(25)30(21)33(2,3)32-28-18-9-7-16-26(28)31-27-17-8-10-19-29(27)32;1-20-19-23-22(21-11-5-4-6-12-21)17-18-30-28(23)29(20)33(2,3)32-26-15-9-7-13-24(26)31-25-14-8-10-16-27(25)32;1-19-18-22-27(21-12-6-5-7-13-21)20(2)32-28(22)29(19)33(3,4)31-25-16-10-8-14-23(25)30-24-15-9-11-17-26(24)31;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-22,24-25,30-31,36H,23H2,1-3H3;6-20,22,26-27,32H,21H2,1-5H3;4-18,20,24-25,30H,19H2,1-3H3;4-20,22,24-26,31H,21H2,1-3H3;5-20,22,25-26,31H,4,21H2,1-3H3;7-11,14-19,21-22,24-25,30H,4-6,12-13,20H2,1-3H3;4-18,20,23,28-29H,19H2,1-3H3;5-17,19,22,28-29H,18H2,1-4H3;8*1H3;16*1H;;;;;;;;/q16*-1;;;;;;;;;;;;;;;;;8*+2/p-16/t25-,30+,31-,36?;22-,26+,27-,32?;20-,24+,25-,30?;22-,24+,25+,26-,31?;22-,25+,26-,31?;21-,24+,25-,30?;20-,23-,28+,29?;19-,22-,28+,29?;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/m11111111................................/s1
InChIKeyAYYXBSHKWHLFNV-UCYWPSHOSA-A
XLogP89.79
TPSA154.32 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds27
Heavy Atoms311
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004894.20
LogP ≤ 589.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium) with MolForge

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What is the IUPAC name of [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)?
The IUPAC name of [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium) (CID 162272741) is [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium).
What is the SMILES notation for [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)?
The canonical SMILES for [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium) is CC1=C(c2ccccc2)[C@H]2C[C@@H](C)C([Si](C)(C)N3c4ccccc4[N-]c4ccccc43)[C@H]2S1.CC[C@@H]1C[C@@H]2C(c3ccccc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(C3CCCCC3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccc(C(F)(F)F)cc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccc(N(C)C)cc3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3cccc(-c4ccccc4)c3)=CC=C[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@@H]2C(c3ccccc3)=CC=N[C@@H]2C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.C[C@@H]1C[C@H]2[C@H](C=CC=C[C@H]2c2ccccc2)C1[Si](C)(C)N1c2ccccc2[N-]c2ccccc21.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.Cl[Ti]Cl.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].
What is the InChIKey of [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)?
The InChIKey is AYYXBSHKWHLFNV-UCYWPSHOSA-A. The full InChI is InChI=1S/C36H35N2Si.C32H36N3Si.C31H30F3N2Si.2C31H33N2Si.C30H37N2Si.C29H30N3Si.C29H31N2SSi.8CH3.16ClH.8Ti/c1-25-23-31-29(28-16-11-15-27(24-28)26-13-5-4-6-14-26)17-12-18-30(31)36(25)39(2,3)38-34-21-9-7-19-32(34)37-33-20-8-10-22-35(33)38;1-22-21-27-25(23-17-19-24(20-18-23)34(2)3)11-10-12-26(27)32(22)36(4,5)35-30-15-8-6-13-28(30)33-29-14-7-9-16-31(29)35;1-20-19-25-23(21-15-17-22(18-16-21)31(32,33)34)9-8-10-24(25)30(20)37(2,3)36-28-13-6-4-11-26(28)35-27-12-5-7-14-29(27)36;1-22-21-26-24(23-13-5-4-6-14-23)15-7-8-16-25(26)31(22)34(2,3)33-29-19-11-9-17-27(29)32-28-18-10-12-20-30(28)33;1-4-22-21-26-24(23-13-6-5-7-14-23)15-12-16-25(26)31(22)34(2,3)33-29-19-10-8-17-27(29)32-28-18-9-11-20-30(28)33;1-21-20-25-23(22-12-5-4-6-13-22)14-11-15-24(25)30(21)33(2,3)32-28-18-9-7-16-26(28)31-27-17-8-10-19-29(27)32;1-20-19-23-22(21-11-5-4-6-12-21)17-18-30-28(23)29(20)33(2,3)32-26-15-9-7-13-24(26)31-25-14-8-10-16-27(25)32;1-19-18-22-27(21-12-6-5-7-13-21)20(2)32-28(22)29(19)33(3,4)31-25-16-10-8-14-23(25)30-24-15-9-11-17-26(24)31;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h4-22,24-25,30-31,36H,23H2,1-3H3;6-20,22,26-27,32H,21H2,1-5H3;4-18,20,24-25,30H,19H2,1-3H3;4-20,22,24-26,31H,21H2,1-3H3;5-20,22,25-26,31H,4,21H2,1-3H3;7-11,14-19,21-22,24-25,30H,4-6,12-13,20H2,1-3H3;4-18,20,23,28-29H,19H2,1-3H3;5-17,19,22,28-29H,18H2,1-4H3;8*1H3;16*1H;;;;;;;;/q16*-1;;;;;;;;;;;;;;;;;8*+2/p-16/t25-,30+,31-,36?;22-,26+,27-,32?;20-,24+,25-,30?;22-,24+,25+,26-,31?;22-,25+,26-,31?;21-,24+,25-,30?;20-,23-,28+,29?;19-,22-,28+,29?;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/m11111111................................/s1.
What are the key properties of [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium)?
[(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium) has a molecular weight of 4894.20 g/mol, XLogP of 89.79, 27 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3aS,7aS)-4-cyclohexyl-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;4-[(2R,3aS,7aS)-1-[dimethyl(phenazin-10-id-5-yl)silyl]-2-methyl-2,3,3a,7a-tetrahydro-1H-inden-4-yl]-N,N-dimethylaniline;[(3aR,5R,6aS)-2,5-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[b]thiophen-6-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-ethyl-4-phenyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aR,4R,8aS)-2-methyl-4-phenyl-1,2,3,3a,4,8a-hexahydroazulen-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(4aR,6R,7aS)-6-methyl-4-phenyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[b]pyridin-7-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-(3-phenylphenyl)-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;[(2R,3aS,7aS)-2-methyl-4-[4-(trifluoromethyl)phenyl]-2,3,3a,7a-tetrahydro-1H-inden-1-yl]-dimethyl-phenazin-10-id-5-ylsilane;carbanide;octakis(dichlorotitanium) is sourced from PubChem (CID 162272741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).