(5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol

C16H11ClN2O — CID 71737853

IUPAC(5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol
SMILESO[C@]1(c2ccc(Cl)cc2)c2ccccc2-c2nccn21
InChIInChI=1S/C16H11ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-10,20H/t16-/m1/s1
InChIKeyRXDGKDABIKRSEL-MRXNPFEDSA-N
MW282.73 g/mol
LogP3.26
Rot. Bonds1

About (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol

(5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol (PubChem CID 71737853) has the molecular formula C16H11ClN2O and a molecular weight of 282.73 g/mol. Its IUPAC name is (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol.

Molecular Properties

Compound Name(5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol
PubChem CID71737853
Molecular FormulaC16H11ClN2O
Molecular Weight282.73 g/mol
Exact Mass282.06
IUPAC Name(5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol
SMILESO[C@]1(c2ccc(Cl)cc2)c2ccccc2-c2nccn21
InChIInChI=1S/C16H11ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-10,20H/t16-/m1/s1
InChIKeyRXDGKDABIKRSEL-MRXNPFEDSA-N
XLogP3.26
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.73
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol?
The IUPAC name of (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol (CID 71737853) is (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol.
What is the SMILES notation for (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol?
The canonical SMILES for (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol is O[C@]1(c2ccc(Cl)cc2)c2ccccc2-c2nccn21.
What is the InChIKey of (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol?
The InChIKey is RXDGKDABIKRSEL-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H11ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-10,20H/t16-/m1/s1.
What are the key properties of (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol?
(5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol has a molecular weight of 282.73 g/mol, XLogP of 3.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-ol is sourced from PubChem (CID 71737853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).