CGP-78608

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C11H13BrN3O5P
Molecular Weight	378.116
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H](NCC1=C2NC(=O)C(=O)NC2=CC(Br)=C1)P(O)(O)=O

InChI

InChIKey=DPFHVUSPVHRVFL-YFKPBYRVSA-N

InChI=1S/C11H13BrN3O5P/c1-5(21(18,19)20)13-4-6-2-7(12)3-8-9(6)15-11(17)10(16)14-8/h2-3,5,13H,4H2,1H3,(H,14,16)(H,15,17)(H2,18,19,20)/t5-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C11H13BrN3O5P
Molecular Weight	378.116
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Glutamate [NMDA] receptor 125 Target ID: CHEMBL2094124 Sources: https://www.ncbi.nlm.nih.gov/pubmed/10636248	Antagonist 2849		5.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Tue Apr 01 17:48:13 GMT 2025` Edited by `admin` on `Tue Apr 01 17:48:13 GMT 2025`
Record UNII	E53G4C95XT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CGP-78608

Common Name

English

CGP 78608

Preferred Name

English

PHOSPHONIC ACID, P-((1S)-1-(((7-BROMO-1,2,3,4-TETRAHYDRO-2,3-DIOXO-5-QUINOXALINYL)METHYL)AMINO)ETHYL)-

Systematic Name

English

P-((1S)-1-(((7-BROMO-1,2,3,4-TETRAHYDRO-2,3-DIOXO-5-QUINOXALINYL)METHYL)AMINO)ETHYL)PHOSPHONIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

E53G4C95XT

Created by admin on Tue Apr 01 17:48:13 GMT 2025 , Edited by admin on Tue Apr 01 17:48:13 GMT 2025

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CAS

206648-13-7

Created by admin on Tue Apr 01 17:48:13 GMT 2025 , Edited by admin on Tue Apr 01 17:48:13 GMT 2025

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EPA CompTox

DTXSID6043886

Created by admin on Tue Apr 01 17:48:13 GMT 2025 , Edited by admin on Tue Apr 01 17:48:13 GMT 2025

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PUBCHEM

6604872

Created by admin on Tue Apr 01 17:48:13 GMT 2025 , Edited by admin on Tue Apr 01 17:48:13 GMT 2025

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