6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione

C22H16Cl2N2O4 — CID 118578333

IUPAC6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione
SMILESCC1(C(=O)C2=C(O)C(=O)N(c3cccc(Cl)c3)C23C(=O)Nc2cc(Cl)ccc23)CC1
InChIInChI=1S/C22H16Cl2N2O4/c1-21(7-8-21)18(28)16-17(27)19(29)26(13-4-2-3-11(23)9-13)22(16)14-6-5-12(24)10-15(14)25-20(22)30/h2-6,9-10,27H,7-8H2,1H3,(H,25,30)
InChIKeyFNYKENNYRXKDAY-UHFFFAOYSA-N
MW443.29 g/mol
LogP4.37
Rot. Bonds3

About 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione

6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione (PubChem CID 118578333) has the molecular formula C22H16Cl2N2O4 and a molecular weight of 443.29 g/mol. Its IUPAC name is 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione.

Molecular Properties

Compound Name6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione
PubChem CID118578333
Molecular FormulaC22H16Cl2N2O4
Molecular Weight443.29 g/mol
Exact Mass442.05
IUPAC Name6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione
SMILESCC1(C(=O)C2=C(O)C(=O)N(c3cccc(Cl)c3)C23C(=O)Nc2cc(Cl)ccc23)CC1
InChIInChI=1S/C22H16Cl2N2O4/c1-21(7-8-21)18(28)16-17(27)19(29)26(13-4-2-3-11(23)9-13)22(16)14-6-5-12(24)10-15(14)25-20(22)30/h2-6,9-10,27H,7-8H2,1H3,(H,25,30)
InChIKeyFNYKENNYRXKDAY-UHFFFAOYSA-N
XLogP4.37
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.29
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-1'-(3-chlorophenyl)-4'-(4-chlorophenyl)sulfanyl-3'-hydroxyspiro[1H-indole-3,5'-pyrrole]-2,2'-dione
CID 129097078
6-chloro-5'-(3-chlorophenyl)-2',2'-dimethylspiro[1H-indole-3,4'-furo[2,3-c]pyrrole]-2,3',6'-trione
CID 129120407
6-chloro-1'-(3-chlorophenyl)-4'-(2,2-dimethylpropanoyl)-3'-hydroxyspiro[1H-indene-3,5'-pyrrole]-2,2'-dione
CID 157300423
6-chloro-4'-(4-chlorophenyl)sulfanyl-3'-hydroxy-1'-methylspiro[1H-indole-3,5'-pyrrole]-2,2'-dione
CID 134469710
6-chloro-3,3-dimethyl-1H-indol-2-one
CID 58398957
methyl 4'-hydroxy-1'-(4-methylphenyl)-2,5'-dioxospiro[1H-indole-3,2'-pyrrole]-3'-carboxylate
CID 102496044
(3R)-6-chloro-5'-(3-chlorophenyl)-2'-(4,6-dimethoxy-3-pyridinyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
CID 150556753
(3S)-6-chloro-5'-(3-chlorophenyl)-2'-(4-ethyl-2-methoxyphenyl)-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
CID 156656496
6-chloro-5'-(3-chlorophenyl)-2'-[2-(dimethylamino)-4-methoxypyrimidin-5-yl]-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
CID 142613231
N-(3-chlorophenyl)-3,3-dimethyl-2-oxo-1H-indole-6-carboxamide
CID 14856608
6-chloro-3,3-difluoro-1H-indol-2-one
CID 58398958
(3S)-6-chloro-5'-(3-chlorophenyl)-2'-[2-(2-fluoroethoxy)-4-methoxypyrimidin-5-yl]-3'-propan-2-ylspiro[1H-indole-3,4'-pyrrolo[3,4-d]imidazole]-2,6'-dione
CID 156656639

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione?
The IUPAC name of 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione (CID 118578333) is 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione.
What is the SMILES notation for 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione?
The canonical SMILES for 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione is CC1(C(=O)C2=C(O)C(=O)N(c3cccc(Cl)c3)C23C(=O)Nc2cc(Cl)ccc23)CC1.
What is the InChIKey of 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione?
The InChIKey is FNYKENNYRXKDAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16Cl2N2O4/c1-21(7-8-21)18(28)16-17(27)19(29)26(13-4-2-3-11(23)9-13)22(16)14-6-5-12(24)10-15(14)25-20(22)30/h2-6,9-10,27H,7-8H2,1H3,(H,25,30).
What are the key properties of 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione?
6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione has a molecular weight of 443.29 g/mol, XLogP of 4.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1'-(3-chlorophenyl)-3'-hydroxy-4'-(1-methylcyclopropanecarbonyl)spiro[1H-indole-3,5'-pyrrole]-2,2'-dione is sourced from PubChem (CID 118578333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).