SML2752
ZINC37781618
≥98% (HPLC)
Synonym(s):
2-Chloro-N-[3-(3-methyl-1H-1,2,4-triazol-5-yl)phenyl]-benzenemethanamine
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About This Item
Empirical Formula (Hill Notation):
C16H15ClN4
CAS Number:
Molecular Weight:
298.77
UNSPSC Code:
12352200
NACRES:
NA.77
SMILES string
Clc1c(cccc1)CNc2cc(ccc2)c3[nH]c(nn3)C
InChI key
BNIQNBVKGOYHPC-UHFFFAOYSA-N
InChI
1S/C16H15ClN4/c1-11-19-16(21-20-11)12-6-4-7-14(9-12)18-10-13-5-2-3-8-15(13)17/h2-9,18H,10H2,1H3,(H,19,20,21)
assay
≥98% (HPLC)
form
powder
color
white to beige
solubility
DMSO: 2 mg/mL, clear
storage temp.
2-8°C
Quality Level
Biochem/physiol Actions
ZINC37781618 is an inactive control for selective melatonin MT1 receptor inverse agonist UCSF7447 (ZINC555417447).
inactive control for selective melatonin MT1 receptor inverse agonist UCSF7447
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
Regulatory Information
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Reed M Stein et al.
Nature, 579(7800), 609-614 (2020-02-11)
The neuromodulator melatonin synchronizes circadian rhythms and related physiological functions through the actions of two G-protein-coupled receptors: MT1 and MT2. Circadian release of melatonin at night from the pineal gland activates melatonin receptors in the suprachiasmatic nucleus of the hypothalamus
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