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N-(((4-cyanophenyl)amino)((diphenylmethyl)amino)methylene)glycine

HCID 4447
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
138460-25-0
Standard SMILES
N#Cc1ccc(NC(=NCC(=O)O)NC(c2ccccc2)c2ccccc2)cc1
InChIKey
KGHMYJFHUHFOGL-UHFFFAOYSA-N
Molecular formula
C23H20N4O2
Average molar mass
384.4 g/mol
Monoisotopic mass
384.15862589

Overview

[N-(4-cyanophenyl)-N'-(diphenylmethyl)guanidine]acetic acid is a trisubstituted guanidine, carrying 4-cyanophenyl, diphenylmethyl and carboxymethyl substituents, which is known to act as a highly potent sweetening agent. It has a role as a sweetening agent and an epitope. It is a glycine derivative and a member of guanidines.

Names & identifiers

Preferred name
N-(((4-cyanophenyl)amino)((diphenylmethyl)amino)methylene)glycine
IUPAC
2-[[(benzhydrylamino)-(4-cyanoanilino)methylidene]amino]acetic acid
English name
NC 174
Molecular formula
C23H20N4O2
Molecular weight
384.43

Names & synonyms

CP-Dpm-GA138460-25-0NC-174NC 174nc174N-(4-Cyanophenyl)-N'-(diphenylmethyl)guanidineacetic acidN-(p-Cyanophenyl)-N'-(diphenylmethyl)-N''-(carboxymethyl)guanidineN-(((4-Cyanophenyl)amino)((diphenylmethyl)amino)methylene)glycineN-{[(4-cyanophenyl)amino][(diphenylmethyl)amino]methylene}glycineRefChem:828533N-(P-CYANOPHENYL)-N'-DIPHENYLMETHYL-GUANIDINE-ACETIC ACIDMW7J9SU4JQ
Show more names
CPDpmGACP-DpmGACPDpm-GACP Dpm GANC 174,NC174Reaxys ID: 25965952
[N-(4-cyanophenyl)-N'-(diphenylmethyl)guanidine]acetic acidCHEBI:3854252-[[(benzhydrylamino)-(4-cyanoanilino)methylidene]amino]acetic acid(N-(p-Cyanophenyl)-N'-(diphenylmethyl)guanidine)acetic acidGlycine, N-[[(4-cyanophenyl)amino][(diphenylmethyl)amino]methylene]-(N(Z))-N-(((4-Cyanophenyl)amino)((diphenylmethyl)amino)methylene)glycine2-[[(benzhydrylamino)-[(4-cyanophenyl)amino]methylidene]amino]ethanoic acidGlycine, N-(((4-cyanophenyl)amino)((diphenylmethyl)amino)methylene)-, (N(Z))-

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
97.5 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
29
Formal charge
0
Complexity
573

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Physicochemical properties

FDA UNII
7 J9SU4JQ · MW7J9SU4JQ

Chemistry & industry

Applications

UsesNC-174 is a super-strong guanidine compound that is sweeter than sucrose. NC-174 is more than 300,000 times sweeter than sucrose and has the potential to be a probe for sweet taste receptors[1].

Suppliers4 total

BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]

Additional notes

DefinitionChEBI: A trisubstituted guanidine, which is known to act as a highly potent sweetening agent.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
138460-25-0、1808181-85-2
PubChem CID
4447
DTXSID
DTXSID70930123
ChEMBL
CHEMBL170077
ChEBI
CHEBI:385425
UNII
MW7J9SU4JQ
Nikkaji
J456.903B