10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one

C26H19ClN4O2S — CID 59156880

IUPAC10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one
SMILESO=C(c1csc(-c2ccccc2)n1)N1CCN2C(=O)c3cccnc3CC12c1ccc(Cl)cc1
InChIInChI=1S/C26H19ClN4O2S/c27-19-10-8-18(9-11-19)26-15-21-20(7-4-12-28-21)24(32)30(26)13-14-31(26)25(33)22-16-34-23(29-22)17-5-2-1-3-6-17/h1-12,16H,13-15H2
InChIKeyJWKPSAMUOOHTPI-UHFFFAOYSA-N
MW486.98 g/mol
LogP4.87
Rot. Bonds3

About 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one

10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one (PubChem CID 59156880) has the molecular formula C26H19ClN4O2S and a molecular weight of 486.98 g/mol. Its IUPAC name is 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one.

Molecular Properties

Compound Name10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one
PubChem CID59156880
Molecular FormulaC26H19ClN4O2S
Molecular Weight486.98 g/mol
Exact Mass486.09
IUPAC Name10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one
SMILESO=C(c1csc(-c2ccccc2)n1)N1CCN2C(=O)c3cccnc3CC12c1ccc(Cl)cc1
InChIInChI=1S/C26H19ClN4O2S/c27-19-10-8-18(9-11-19)26-15-21-20(7-4-12-28-21)24(32)30(26)13-14-31(26)25(33)22-16-34-23(29-22)17-5-2-1-3-6-17/h1-12,16H,13-15H2
InChIKeyJWKPSAMUOOHTPI-UHFFFAOYSA-N
XLogP4.87
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.98
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?
The IUPAC name of 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one (CID 59156880) is 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one.
What is the SMILES notation for 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?
The canonical SMILES for 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one is O=C(c1csc(-c2ccccc2)n1)N1CCN2C(=O)c3cccnc3CC12c1ccc(Cl)cc1.
What is the InChIKey of 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?
The InChIKey is JWKPSAMUOOHTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19ClN4O2S/c27-19-10-8-18(9-11-19)26-15-21-20(7-4-12-28-21)24(32)30(26)13-14-31(26)25(33)22-16-34-23(29-22)17-5-2-1-3-6-17/h1-12,16H,13-15H2.
What are the key properties of 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one?
10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one has a molecular weight of 486.98 g/mol, XLogP of 4.87, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10a-(4-chlorophenyl)-1-(2-phenyl-1,3-thiazole-4-carbonyl)-3,10-dihydro-2H-imidazo[1,2-g][1,6]naphthyridin-5-one is sourced from PubChem (CID 59156880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).