2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole

C24H26BrNSi2 — CID 134933048

IUPAC2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole
SMILESC[Si]1(C)c2ccccc2[Si](C)(C)N1/C=C(/c1ccccc1)c1ccc(Br)cc1
InChIInChI=1S/C24H26BrNSi2/c1-27(2)23-12-8-9-13-24(23)28(3,4)26(27)18-22(19-10-6-5-7-11-19)20-14-16-21(25)17-15-20/h5-18H,1-4H3/b22-18-
InChIKeyAAKGMQJJWPKWJX-PYCFMQQDSA-N
MW464.56 g/mol
LogP5.68
Rot. Bonds3

About 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole

2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole (PubChem CID 134933048) has the molecular formula C24H26BrNSi2 and a molecular weight of 464.56 g/mol. Its IUPAC name is 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole.

Molecular Properties

Compound Name2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole
PubChem CID134933048
Molecular FormulaC24H26BrNSi2
Molecular Weight464.56 g/mol
Exact Mass463.08
IUPAC Name2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole
SMILESC[Si]1(C)c2ccccc2[Si](C)(C)N1/C=C(/c1ccccc1)c1ccc(Br)cc1
InChIInChI=1S/C24H26BrNSi2/c1-27(2)23-12-8-9-13-24(23)28(3,4)26(27)18-22(19-10-6-5-7-11-19)20-14-16-21(25)17-15-20/h5-18H,1-4H3/b22-18-
InChIKeyAAKGMQJJWPKWJX-PYCFMQQDSA-N
XLogP5.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.56
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-[(Z)-2-(4-bromophenyl)prop-1-enyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole
CID 134932134
2-[(E)-5-bromo-2-phenylpent-1-enyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole
CID 134933047
3,7-Dibromo-5-methyl-5-phenylbenzo[b][1]benzosilole
CID 155787125
3-Bromo-5-methyl-5-phenylbenzo[b][1]benzosilole
CID 155787252
3-Bromo-5,5-dimethyl-7-phenylbenzo[b][1]benzosilole
CID 173603124
2,3-Bis(4-bromophenyl)-1,1-dimethyl-1-benzosilole
CID 101808895

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole?
The IUPAC name of 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole (CID 134933048) is 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole.
What is the SMILES notation for 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole?
The canonical SMILES for 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole is C[Si]1(C)c2ccccc2[Si](C)(C)N1/C=C(/c1ccccc1)c1ccc(Br)cc1.
What is the InChIKey of 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole?
The InChIKey is AAKGMQJJWPKWJX-PYCFMQQDSA-N. The full InChI is InChI=1S/C24H26BrNSi2/c1-27(2)23-12-8-9-13-24(23)28(3,4)26(27)18-22(19-10-6-5-7-11-19)20-14-16-21(25)17-15-20/h5-18H,1-4H3/b22-18-.
What are the key properties of 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole?
2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole has a molecular weight of 464.56 g/mol, XLogP of 5.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-(4-bromophenyl)-2-phenylethenyl]-1,1,3,3-tetramethyl-2,1,3-benzazadisilole is sourced from PubChem (CID 134933048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).