Y508-8909 Screening compound: 4-({(E)-1-[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}amino)-4H-1,2,4-triazol-3-ylhydrosulfide
Chemical Structure Depiction of ChemDiv screening compound Y508-8909
4-({(E)-1-[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}amino)-4H-1,2,4-triazol-3-ylhydrosulfide
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
Y508-8909
Molecular Formula
C11H10F2N4O2S (C11 H10 F2 N4 O2 S)
Compound Name
4-({(E)-1-[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}amino)-4H-1,2,4-triazol-3-ylhydrosulfide
IUPAC name
n/a
SMILES
COc(cc(/C=N/n1c(S)nnc1)cc1)c1OC(F)F
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
300.29
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
0.910
Distribution Coefficient, logD
0.861
Water Solubility, LogSw
-1.85
Polar Surface Area
47.710
Acid Dissociation Constant (pKa)
8.39
Base Dissociation Constant (pKb)
5.59
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
18.20
References: we are preparing a list of scientific research reports with Y508-8909 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)