6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole

C19H16Br2N2 — CID 155941539

IUPAC6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole
SMILESCC(C)(c1c[nH]c2cc(Br)ccc12)c1c[nH]c2cc(Br)ccc12
InChIInChI=1S/C19H16Br2N2/c1-19(2,15-9-22-17-7-11(20)3-5-13(15)17)16-10-23-18-8-12(21)4-6-14(16)18/h3-10,22-23H,1-2H3
InChIKeyBIXZTURKTMEMNS-UHFFFAOYSA-N
MW432.16 g/mol
LogP6.50
Rot. Bonds2

About 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole

6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole (PubChem CID 155941539) has the molecular formula C19H16Br2N2 and a molecular weight of 432.16 g/mol. Its IUPAC name is 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole.

Molecular Properties

Compound Name6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole
PubChem CID155941539
Molecular FormulaC19H16Br2N2
Molecular Weight432.16 g/mol
Exact Mass429.97
IUPAC Name6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole
SMILESCC(C)(c1c[nH]c2cc(Br)ccc12)c1c[nH]c2cc(Br)ccc12
InChIInChI=1S/C19H16Br2N2/c1-19(2,15-9-22-17-7-11(20)3-5-13(15)17)16-10-23-18-8-12(21)4-6-14(16)18/h3-10,22-23H,1-2H3
InChIKeyBIXZTURKTMEMNS-UHFFFAOYSA-N
XLogP6.50
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.16
LogP ≤ 56.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

2-(6-bromo-1H-indol-3-yl)-N,2-dimethylpropan-1-amine
CID 84642871
2-(6-bromo-1H-indol-3-yl)-2-ethylbutanenitrile
CID 154958366
1-(6-bromo-1H-indol-3-yl)-2-methylpropan-2-ol
CID 84712066
6-(4,5-dihydro-1H-imidazol-2-yl)-3-[2-[6-(4,5-dihydro-1H-imidazol-2-yl)-1H-indol-3-yl]propan-2-yl]-1H-indole
CID 134131009
2-(5-bromo-1H-indol-3-yl)-2-methylpropanenitrile
CID 86668667
6-bromo-3-(4-bromophenyl)-1H-indole
CID 118648675
6-bromo-1H-indol-3-ol;phosphoric acid
CID 135389689
6-bromo-3-isocyano-1H-indole
CID 59831783
N-(6-bromo-1H-indol-3-yl)acetamide
CID 70122849
2,2-dibromo-1-(6-bromo-1H-indol-3-yl)ethanone
CID 135045023
(6-bromo-1H-indol-3-yl)-(4,5-dimethylthiophen-2-yl)methanone
CID 65237633
(S)-(6-bromo-1H-indol-3-yl)-(6-bromo-1-methoxycarbonylindol-3-yl)-methoxymethanesulfonic acid
CID 163038085

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole?
The IUPAC name of 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole (CID 155941539) is 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole.
What is the SMILES notation for 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole?
The canonical SMILES for 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole is CC(C)(c1c[nH]c2cc(Br)ccc12)c1c[nH]c2cc(Br)ccc12.
What is the InChIKey of 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole?
The InChIKey is BIXZTURKTMEMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16Br2N2/c1-19(2,15-9-22-17-7-11(20)3-5-13(15)17)16-10-23-18-8-12(21)4-6-14(16)18/h3-10,22-23H,1-2H3.
What are the key properties of 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole?
6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole has a molecular weight of 432.16 g/mol, XLogP of 6.50, 2 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-[2-(6-bromo-1H-indol-3-yl)propan-2-yl]-1H-indole is sourced from PubChem (CID 155941539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).