(4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone

C15H8Cl2FNO — CID 103427771

IUPAC(4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone
SMILESO=C(c1ccccc1F)c1c[nH]c2cc(Cl)cc(Cl)c12
InChIInChI=1S/C15H8Cl2FNO/c16-8-5-11(17)14-10(7-19-13(14)6-8)15(20)9-3-1-2-4-12(9)18/h1-7,19H
InChIKeyPAQNVPNRKWTGFK-UHFFFAOYSA-N
MW308.14 g/mol
LogP4.84
Rot. Bonds2

About (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone

(4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone (PubChem CID 103427771) has the molecular formula C15H8Cl2FNO and a molecular weight of 308.14 g/mol. Its IUPAC name is (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone.

Molecular Properties

Compound Name(4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone
PubChem CID103427771
Molecular FormulaC15H8Cl2FNO
Molecular Weight308.14 g/mol
Exact Mass307.00
IUPAC Name(4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone
SMILESO=C(c1ccccc1F)c1c[nH]c2cc(Cl)cc(Cl)c12
InChIInChI=1S/C15H8Cl2FNO/c16-8-5-11(17)14-10(7-19-13(14)6-8)15(20)9-3-1-2-4-12(9)18/h1-7,19H
InChIKeyPAQNVPNRKWTGFK-UHFFFAOYSA-N
XLogP4.84
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.14
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-amino-3-chlorophenyl)-(4,6-dichloro-1H-indol-3-yl)methanone
CID 103428602
(4-bromophenyl)-(4,6-dichloro-1H-indol-3-yl)methanone
CID 103427878
(4-aminophenyl)-(4,6-dichloro-1H-indol-3-yl)methanone
CID 103428591
(4,6-dichloro-1H-indol-3-yl)-(4-iodophenyl)methanone
CID 103427836
(2-amino-5-methylphenyl)-(4,6-dichloro-1H-indol-3-yl)methanone
CID 103428580
(3-bromo-4-chlorophenyl)-(4,6-dichloro-1H-indol-3-yl)methanone
CID 107998441
(3-aminophenyl)-(4,6-dichloro-1H-indol-3-yl)methanone
CID 103428581
1-(4,6-dichloro-1H-indol-3-yl)-3,3-dimethylbutan-1-one
CID 103427821
(3-chloro-4-fluorophenyl)-(4-chloro-1H-indol-3-yl)methanone
CID 82874432
3-(5-chloro-2-fluorobenzoyl)-1H-indole-4-carbonitrile
CID 107918718
(2-fluorophenyl)-(5-methyl-1H-indol-3-yl)methanone
CID 63555321
[2-(2-fluorobenzoyl)phenyl]-(2-fluorophenyl)methanone
CID 130332183

Frequently Asked Questions

What is the IUPAC name of (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone?
The IUPAC name of (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone (CID 103427771) is (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone.
What is the SMILES notation for (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone?
The canonical SMILES for (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone is O=C(c1ccccc1F)c1c[nH]c2cc(Cl)cc(Cl)c12.
What is the InChIKey of (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone?
The InChIKey is PAQNVPNRKWTGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl2FNO/c16-8-5-11(17)14-10(7-19-13(14)6-8)15(20)9-3-1-2-4-12(9)18/h1-7,19H.
What are the key properties of (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone?
(4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone has a molecular weight of 308.14 g/mol, XLogP of 4.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4,6-dichloro-1H-indol-3-yl)-(2-fluorophenyl)methanone is sourced from PubChem (CID 103427771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).