(3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one

C14H9Br2NO2 — CID 7353933

IUPAC(3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccc(Br)cc2[C@@H]1c1cc(Br)ccc1O
InChIInChI=1S/C14H9Br2NO2/c15-7-1-3-11-9(5-7)13(14(19)17-11)10-6-8(16)2-4-12(10)18/h1-6,13,18H,(H,17,19)/t13-/m1/s1
InChIKeyLQDZIHXXJZXSNI-CYBMUJFWSA-N
MW383.04 g/mol
LogP4.00
Rot. Bonds1

About (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one

(3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one (PubChem CID 7353933) has the molecular formula C14H9Br2NO2 and a molecular weight of 383.04 g/mol. Its IUPAC name is (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name(3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one
PubChem CID7353933
Molecular FormulaC14H9Br2NO2
Molecular Weight383.04 g/mol
Exact Mass380.90
IUPAC Name(3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccc(Br)cc2[C@@H]1c1cc(Br)ccc1O
InChIInChI=1S/C14H9Br2NO2/c15-7-1-3-11-9(5-7)13(14(19)17-11)10-6-8(16)2-4-12(10)18/h1-6,13,18H,(H,17,19)/t13-/m1/s1
InChIKeyLQDZIHXXJZXSNI-CYBMUJFWSA-N
XLogP4.00
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.04
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one?
The IUPAC name of (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one (CID 7353933) is (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one?
The canonical SMILES for (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one is O=C1Nc2ccc(Br)cc2[C@@H]1c1cc(Br)ccc1O.
What is the InChIKey of (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one?
The InChIKey is LQDZIHXXJZXSNI-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H9Br2NO2/c15-7-1-3-11-9(5-7)13(14(19)17-11)10-6-8(16)2-4-12(10)18/h1-6,13,18H,(H,17,19)/t13-/m1/s1.
What are the key properties of (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one?
(3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one has a molecular weight of 383.04 g/mol, XLogP of 4.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-bromo-3-(5-bromo-2-hydroxyphenyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 7353933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).