7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one

C19H13ClFN5O — CID 155806988

IUPAC7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESNNc1nc2nc(-c3ccc(Cl)cc3)cc(-c3ccc(F)cc3)c2c(=O)[nH]1
InChIInChI=1S/C19H13ClFN5O/c20-12-5-1-11(2-6-12)15-9-14(10-3-7-13(21)8-4-10)16-17(23-15)24-19(26-22)25-18(16)27/h1-9H,22H2,(H2,23,24,25,26,27)
InChIKeyYRPGZDLLTPWAFC-UHFFFAOYSA-N
MW381.80 g/mol
LogP3.73
Rot. Bonds3

About 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one

7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one (PubChem CID 155806988) has the molecular formula C19H13ClFN5O and a molecular weight of 381.80 g/mol. Its IUPAC name is 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one
PubChem CID155806988
Molecular FormulaC19H13ClFN5O
Molecular Weight381.80 g/mol
Exact Mass381.08
IUPAC Name7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESNNc1nc2nc(-c3ccc(Cl)cc3)cc(-c3ccc(F)cc3)c2c(=O)[nH]1
InChIInChI=1S/C19H13ClFN5O/c20-12-5-1-11(2-6-12)15-9-14(10-3-7-13(21)8-4-10)16-17(23-15)24-19(26-22)25-18(16)27/h1-9H,22H2,(H2,23,24,25,26,27)
InChIKeyYRPGZDLLTPWAFC-UHFFFAOYSA-N
XLogP3.73
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.80
LogP ≤ 53.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

7-(2-Chlorophenyl)-6-(4-chlorophenyl)-2-isopropylpyrido[2,3-d]pyrimidin-4-ol
CID 135923581
2-Tert-butyl-7-(2-chlorophenyl)-6-(4-chlorophenyl)pyrido[2,3-d]pyrimidin-4-ol
CID 135923694
2-Tert-butyl-6-(4-chlorophenyl)-7-(2,4-dichlorophenyl)pyrido[2,3-d]pyrimidin-4-ol
CID 135923695
7-(2-Chlorophenyl)-2,6-bis(4-chlorophenyl)pyrido[2,3-d]pyrimidin-4-ol
CID 135923696
7-(4-chlorophenyl)-2-(5-methyl-3-oxo-1H-pyrazol-2-yl)-5-(4-methylphenyl)-3H-pyrido[2,3-d]pyrimidin-4-one
CID 168273480
2-(4-Chloro-phenyl)-5,7-dimethyl-1H-[1,8]naphthyridin-4-one
CID 5468913
Benzamide, N-(((5-(4-chlorophenyl)-4,6-dimethyl-2-pyridinyl)amino)carbonyl)-2,6-difluoro-
CID 158450
2-(1-(2,4-dichloro-5-fluorophenyl)ethylamino)-3-(4-fluorophenyl)-1,6-naphthyridin-5(6H)-one
CID 52942449
7-(2-Chlorophenyl)-6-(4-chlorophenyl)-2-methylpyrido[2,3-d]pyrimidin-4-ol
CID 136059727
(9Z)-5-(4-chlorophenyl)-9-[(4-chlorophenyl)methylidene]-2-hydrazinyl-3,6,7,8-tetrahydropyrimido[4,5-b]quinolin-4-one
CID 136117809
5-(4-chlorophenyl)-7-phenyl-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidin-4-one
CID 10361510
10-(4-Chlorophenyl)-12-phenyl-2,4,5,7,13-pentazatricyclo[7.4.0.03,7]trideca-1(9),2,5,10,12-pentaen-8-one
CID 53304800

Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one (CID 155806988) is 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one is NNc1nc2nc(-c3ccc(Cl)cc3)cc(-c3ccc(F)cc3)c2c(=O)[nH]1.
What is the InChIKey of 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The InChIKey is YRPGZDLLTPWAFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClFN5O/c20-12-5-1-11(2-6-12)15-9-14(10-3-7-13(21)8-4-10)16-17(23-15)24-19(26-22)25-18(16)27/h1-9H,22H2,(H2,23,24,25,26,27).
What are the key properties of 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one?
7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 381.80 g/mol, XLogP of 3.73, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-chlorophenyl)-5-(4-fluorophenyl)-2-hydrazinyl-3H-pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 155806988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).