1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine

C92H60F12N6O4 — CID 162160648

About 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine

1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine (PubChem CID 162160648) has the molecular formula C92H60F12N6O4 and a molecular weight of 1541.51 g/mol. Its IUPAC name is 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine.

Molecular Properties

• Compound Name: 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine
• PubChem CID: 162160648
• Molecular Formula: C92H60F12N6O4
• Molecular Weight: 1541.51 g/mol
• Exact Mass: 1540.45
• IUPAC Name: 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine
• SMILES: FC(F)=C(F)Oc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccc(OC(F)=C(F)F)cc4)cc3)cc2)cc1.FC(F)=C(F)Oc1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccc(OC(F)=C(F)F)cc4)ccc2n3-c2ccccc2)cc1
• InChI: InChI=1S/C46H29F6N3O2.C46H31F6N3O2/c47-43(48)45(51)56-37-22-16-33(17-23-37)53(30-10-4-1-5-11-30)35-20-26-41-39(28-35)40-29-36(21-27-42(40)55(41)32-14-8-3-9-15-32)54(31-12-6-2-7-13-31)34-18-24-38(25-19-34)57-46(52)44(49)50;47-43(48)45(51)56-41-28-24-39(25-29-41)54(33-12-6-2-7-13-33)37-20-16-35(17-21-37)53(32-10-4-1-5-11-32)36-18-22-38(23-19-36)55(34-14-8-3-9-15-34)40-26-30-42(31-27-40)57-46(52)44(49)50/h1-29H;1-31H
• InChIKey: ZMKVBNUSYKFVAV-UHFFFAOYSA-N
• XLogP: 29.47
• TPSA: 58.05 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 24
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1541.51
LogP ≤ 5	29.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine?

The IUPAC name of 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine (CID 162160648) is 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine.

What is the SMILES notation for 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine?

The canonical SMILES for 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine is FC(F)=C(F)Oc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccc(OC(F)=C(F)F)cc4)cc3)cc2)cc1.FC(F)=C(F)Oc1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccccc4)c4ccc(OC(F)=C(F)F)cc4)ccc2n3-c2ccccc2)cc1.

What is the InChIKey of 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine?

The InChIKey is ZMKVBNUSYKFVAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H29F6N3O2.C46H31F6N3O2/c47-43(48)45(51)56-37-22-16-33(17-23-37)53(30-10-4-1-5-11-30)35-20-26-41-39(28-35)40-29-36(21-27-42(40)55(41)32-14-8-3-9-15-32)54(31-12-6-2-7-13-31)34-18-24-38(25-19-34)57-46(52)44(49)50;47-43(48)45(51)56-41-28-24-39(25-29-41)54(33-12-6-2-7-13-33)37-20-16-35(17-21-37)53(32-10-4-1-5-11-32)36-18-22-38(23-19-36)55(34-14-8-3-9-15-34)40-26-30-42(31-27-40)57-46(52)44(49)50/h1-29H;1-31H.

What are the key properties of 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine?

1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine has a molecular weight of 1541.51 g/mol, XLogP of 29.47, 24 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 1-N,4-N-diphenyl-4-N-[4-(1,2,2-trifluoroethenoxy)phenyl]-1-N-[4-(N-[4-(1,2,2-trifluoroethenoxy)phenyl]anilino)phenyl]benzene-1,4-diamine;3-N,6-N,9-triphenyl-3-N,6-N-bis[4-(1,2,2-trifluoroethenoxy)phenyl]carbazole-3,6-diamine is sourced from PubChem (CID 162160648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).