5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one

C22H15BrClNO — CID 175097464

IUPAC5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESO=C1Nc2ccc(Br)cc2C12CC2(c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C22H15BrClNO/c23-15-10-11-19-17(12-15)22(20(26)25-19)13-21(22,14-6-2-1-3-7-14)16-8-4-5-9-18(16)24/h1-12H,13H2,(H,25,26)
InChIKeyZVCWVRMVFSYVRM-UHFFFAOYSA-N
MW424.73 g/mol
LogP5.68
Rot. Bonds2

About 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one

5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one (PubChem CID 175097464) has the molecular formula C22H15BrClNO and a molecular weight of 424.73 g/mol. Its IUPAC name is 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one.

Molecular Properties

Compound Name5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one
PubChem CID175097464
Molecular FormulaC22H15BrClNO
Molecular Weight424.73 g/mol
Exact Mass423.00
IUPAC Name5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one
SMILESO=C1Nc2ccc(Br)cc2C12CC2(c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C22H15BrClNO/c23-15-10-11-19-17(12-15)22(20(26)25-19)13-21(22,14-6-2-1-3-7-14)16-8-4-5-9-18(16)24/h1-12H,13H2,(H,25,26)
InChIKeyZVCWVRMVFSYVRM-UHFFFAOYSA-N
XLogP5.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.73
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-bromo-5-chloro-2',2'-diphenylspiro[1H-indole-3,1'-cyclopropane]-2-one;5',7'-dibromo-1'-methyl-2,2-diphenylspiro[cyclopropane-1,3'-indole]-2'-one
CID 167570058
(3'S,5'S)-5-bromo-3',5'-diphenylspiro[1H-indole-3,4'-cyclohexane]-1',2-dione
CID 57379164
5'-bromospiro[1,3-dithiolane-2,3'-1H-indole]-2'-one
CID 1262495
5-bromospiro[1H-indole-3,1'-cyclobutane]-2-one;ethane
CID 145209276
5-bromo-3-(4-bromophenyl)-3-(pyridin-2-ylmethyl)-1H-indol-2-one
CID 102494025
[(1'S,3R)-2-oxo-1'-phenylspiro[1H-indole-3,2'-cyclopropane]-1'-yl] acetate
CID 46900703
(3R)-5-bromo-3-hydroxy-3-phenacyl-1H-indol-2-one
CID 785764
(3S)-3-methyl-3-phenyl-1H-indol-2-one
CID 102419408
3-(5-bromo-2-fluorophenyl)-3-hydroxy-1H-indol-2-one
CID 83037208
(3S)-1',1'-dichloro-5-methylspiro[1H-indole-3,2'-cyclopropane]-2-one
CID 175639660
3,3-dichloro-1H-indol-2-one
CID 719018
(3R)-3-[(4-bromophenyl)methylamino]-3-phenyl-1H-indol-2-one
CID 122496530

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The IUPAC name of 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one (CID 175097464) is 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one.
What is the SMILES notation for 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The canonical SMILES for 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one is O=C1Nc2ccc(Br)cc2C12CC2(c1ccccc1)c1ccccc1Cl.
What is the InChIKey of 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one?
The InChIKey is ZVCWVRMVFSYVRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15BrClNO/c23-15-10-11-19-17(12-15)22(20(26)25-19)13-21(22,14-6-2-1-3-7-14)16-8-4-5-9-18(16)24/h1-12H,13H2,(H,25,26).
What are the key properties of 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one?
5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one has a molecular weight of 424.73 g/mol, XLogP of 5.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2'-(2-chlorophenyl)-2'-phenylspiro[1H-indole-3,1'-cyclopropane]-2-one is sourced from PubChem (CID 175097464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).