5,7-dichloro-3-(1H-indol-3-yl)-1H-indole

C16H10Cl2N2 — CID 10518361

IUPAC5,7-dichloro-3-(1H-indol-3-yl)-1H-indole
SMILESClc1cc(Cl)c2[nH]cc(-c3c[nH]c4ccccc34)c2c1
InChIInChI=1S/C16H10Cl2N2/c17-9-5-11-13(8-20-16(11)14(18)6-9)12-7-19-15-4-2-1-3-10(12)15/h1-8,19-20H
InChIKeyQAFCHMKYOROXTC-UHFFFAOYSA-N
MW301.18 g/mol
LogP5.62
Rot. Bonds1

About 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole

5,7-dichloro-3-(1H-indol-3-yl)-1H-indole (PubChem CID 10518361) has the molecular formula C16H10Cl2N2 and a molecular weight of 301.18 g/mol. Its IUPAC name is 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole.

Molecular Properties

Compound Name5,7-dichloro-3-(1H-indol-3-yl)-1H-indole
PubChem CID10518361
Molecular FormulaC16H10Cl2N2
Molecular Weight301.18 g/mol
Exact Mass300.02
IUPAC Name5,7-dichloro-3-(1H-indol-3-yl)-1H-indole
SMILESClc1cc(Cl)c2[nH]cc(-c3c[nH]c4ccccc34)c2c1
InChIInChI=1S/C16H10Cl2N2/c17-9-5-11-13(8-20-16(11)14(18)6-9)12-7-19-15-4-2-1-3-10(12)15/h1-8,19-20H
InChIKeyQAFCHMKYOROXTC-UHFFFAOYSA-N
XLogP5.62
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.18
LogP ≤ 55.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Related Compounds

7-chloro-4-(1H-indol-3-yl)-1H-quinolin-2-one
CID 138961466
3-[4-(1H-indol-3-yl)phenyl]-1H-indole
CID 175007681
[3-chloro-2-(1H-indol-3-yl)phenyl]methanamine
CID 122439577
2-(1H-indol-3-yl)aniline
CID 25210227
7-ethyl-3-(1H-indol-3-yl)-1H-indole
CID 46901494
3-(4-chloro-1H-pyrazol-5-yl)-1H-indole
CID 145022790
5,7-dichloro-3-[1-(4-methylphenyl)tetrazol-5-yl]-1H-indole
CID 822895
methane;3-phenyl-1H-indole
CID 167711687
3-pyridin-4-yl-1H-indole;1-pyridin-4-yl-3-(2,4,6-trichlorophenyl)propan-2-one
CID 157118396
3-(3,5-dimethylphenyl)-1H-indole
CID 169241956
5,6-dichloro-3-[4-(5-chloro-1H-indol-3-yl)-1H-pyrrol-3-yl]-1H-indole
CID 71101477
6-(1H-indol-3-yl)-1,3,5-triazine-2,4-diamine
CID 14358165

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole?
The IUPAC name of 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole (CID 10518361) is 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole.
What is the SMILES notation for 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole?
The canonical SMILES for 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole is Clc1cc(Cl)c2[nH]cc(-c3c[nH]c4ccccc34)c2c1.
What is the InChIKey of 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole?
The InChIKey is QAFCHMKYOROXTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2/c17-9-5-11-13(8-20-16(11)14(18)6-9)12-7-19-15-4-2-1-3-10(12)15/h1-8,19-20H.
What are the key properties of 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole?
5,7-dichloro-3-(1H-indol-3-yl)-1H-indole has a molecular weight of 301.18 g/mol, XLogP of 5.62, 1 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-3-(1H-indol-3-yl)-1H-indole is sourced from PubChem (CID 10518361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).