methylRed – 4′-dimethylaminoazobenzene-2-carboxylic acid

Name
WID methylRed View in model
Name 4′-dimethylaminoazobenzene-2-carboxylic acid View in model
Traditional name 2-{2-[4-(dimethylamino)phenyl]diazen-1-yl}benzoate
IUPAC name 2-{2-[4-(dimethylamino)phenyl]diazen-1-yl}benzoate
Cross references PubChem: 24579432, CAS: 845-10-3, BioCyc: CPD0-1147
 
Classification
Type antibiotic View in model
 
Structure
Empirical formula (pH 7.5) H14C15N3O2
SMILES (pH 7.5) CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)[O-]
Charge (pH 7.5) -1
Is hydrophobic False View in model
Molecular weight (Da) 268.29 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
242.33
pI 3.58
logP 3.31
logD (pH 7.5) 0.790
 
Function
Reaction participant methyl red azoreductase
[c]: (2) H + methylRed + (2) NADHaminodimethylaniline + anthranilate + (2) NAD
View in model
 
Metadata
Created 2012-10-01 15:07:03
Last updated 2012-10-01 15:12:21