N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide

C23H17N3O2 — CID 102152407

IUPACN-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)C(c1ccccc1)N1C(=O)c3ccccc3C1=N2
InChIInChI=1S/C23H17N3O2/c1-14(27)24-16-11-12-20-19(13-16)21(15-7-3-2-4-8-15)26-22(25-20)17-9-5-6-10-18(17)23(26)28/h2-13,21H,1H3,(H,24,27)
InChIKeyQIEXLKLQAJYXGX-UHFFFAOYSA-N
MW367.41 g/mol
LogP4.28
Rot. Bonds2

About N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide

N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide (PubChem CID 102152407) has the molecular formula C23H17N3O2 and a molecular weight of 367.41 g/mol. Its IUPAC name is N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide.

Molecular Properties

Compound NameN-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide
PubChem CID102152407
Molecular FormulaC23H17N3O2
Molecular Weight367.41 g/mol
Exact Mass367.13
IUPAC NameN-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)C(c1ccccc1)N1C(=O)c3ccccc3C1=N2
InChIInChI=1S/C23H17N3O2/c1-14(27)24-16-11-12-20-19(13-16)21(15-7-3-2-4-8-15)26-22(25-20)17-9-5-6-10-18(17)23(26)28/h2-13,21H,1H3,(H,24,27)
InChIKeyQIEXLKLQAJYXGX-UHFFFAOYSA-N
XLogP4.28
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide?
The IUPAC name of N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide (CID 102152407) is N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide.
What is the SMILES notation for N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide?
The canonical SMILES for N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide is CC(=O)Nc1ccc2c(c1)C(c1ccccc1)N1C(=O)c3ccccc3C1=N2.
What is the InChIKey of N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide?
The InChIKey is QIEXLKLQAJYXGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O2/c1-14(27)24-16-11-12-20-19(13-16)21(15-7-3-2-4-8-15)26-22(25-20)17-9-5-6-10-18(17)23(26)28/h2-13,21H,1H3,(H,24,27).
What are the key properties of N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide?
N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide has a molecular weight of 367.41 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(12-oxo-10-phenyl-10H-isoindolo[1,2-b]quinazolin-8-yl)acetamide is sourced from PubChem (CID 102152407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).