7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one

C14H8Cl2N2O2 — CID 54730152

IUPAC7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one
SMILESO=c1[nH]c2cc(Cl)cnc2c(O)c1-c1cccc(Cl)c1
InChIInChI=1S/C14H8Cl2N2O2/c15-8-3-1-2-7(4-8)11-13(19)12-10(18-14(11)20)5-9(16)6-17-12/h1-6H,(H2,18,19,20)
InChIKeyBTIRJCIECRIBOV-UHFFFAOYSA-N
MW307.14 g/mol
LogP3.60
Rot. Bonds1

About 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one

7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one (PubChem CID 54730152) has the molecular formula C14H8Cl2N2O2 and a molecular weight of 307.14 g/mol. Its IUPAC name is 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one
PubChem CID54730152
Molecular FormulaC14H8Cl2N2O2
Molecular Weight307.14 g/mol
Exact Mass306.00
IUPAC Name7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one
SMILESO=c1[nH]c2cc(Cl)cnc2c(O)c1-c1cccc(Cl)c1
InChIInChI=1S/C14H8Cl2N2O2/c15-8-3-1-2-7(4-8)11-13(19)12-10(18-14(11)20)5-9(16)6-17-12/h1-6H,(H2,18,19,20)
InChIKeyBTIRJCIECRIBOV-UHFFFAOYSA-N
XLogP3.60
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-benzyl-N-[(2-chloro-4-fluoro-phenyl)methyl]-4-hydroxy-2-oxo-1H-1,5-naphthyridine-3-carboxamide
CID 57395638
3-[(4-Tert-butylbenzoyl)amino]-5-chloropyridine-2-carboxylic acid
CID 162643753
7-Chloro-4-hydroxy-3-(3-methoxyphenyl)-1,5-naphthyridin-2(1H)-one
CID 54730154
6-chloro-3-(3-chlorophenyl)-1H-1,7-naphthyridin-2-one
CID 45267794
7-chloro-4-hydroxy-3-(3-nitrophenyl)-1H-1,5-naphthyridin-2-one
CID 54730150
7-chloro-4-hydroxy-3-(3-methylphenyl)-1H-1,5-naphthyridin-2-one
CID 54730153
7-chloro-4-hydroxy-3-phenyl-1H-1,5-naphthyridin-2-one
CID 54730156
5-Chloro-3-[(4-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 162672077
3-Benzamido-5-chloropyridine-2-carboxylic acid
CID 162676309
5-chloro-N-(6-chloro-3-pyridinyl)-2-hydroxybenzamide
CID 10379068
5-(m-Chlorobenzylamino)-pyridine-2-carboxylic acid
CID 12640190
5-(4-Chloro-benzoylamino)-pyridine-2-carboxylic acid; Hydrate
CID 15121199

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one?
The IUPAC name of 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one (CID 54730152) is 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one is O=c1[nH]c2cc(Cl)cnc2c(O)c1-c1cccc(Cl)c1.
What is the InChIKey of 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one?
The InChIKey is BTIRJCIECRIBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2O2/c15-8-3-1-2-7(4-8)11-13(19)12-10(18-14(11)20)5-9(16)6-17-12/h1-6H,(H2,18,19,20).
What are the key properties of 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one?
7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one has a molecular weight of 307.14 g/mol, XLogP of 3.60, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(3-chlorophenyl)-4-hydroxy-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 54730152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).