Y700-0482 Screening compound: N~1~-{[(2S)-2,3-dihydroxypropyl]oxy}-3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzamide
Chemical Structure Depiction of ChemDiv screening compound Y700-0482
N~1~-{[(2S)-2,3-dihydroxypropyl]oxy}-3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzamide
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
Y700-0482
Molecular Formula
C16H14F3IN2O4 (C16 H14 F3 IN2 O4)
Compound Name
N~1~-{[(2S)-2,3-dihydroxypropyl]oxy}-3,4-difluoro-2-(2-fluoro-4-iodoanilino)benzamide
IUPAC name
n/a
SMILES
OC[C@@H](CONC(c(c(Nc(ccc(I)c1)c1F)c1F)ccc1F)=O)O
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
482.2
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
4.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.223
Distribution Coefficient, logD
2.993
Water Solubility, LogSw
-3.49
Polar Surface Area
75.285
Acid Dissociation Constant (pKa)
7.56
Base Dissociation Constant (pKb)
-4.98
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
18.80
References: we are preparing a list of scientific research reports with Y700-0482 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)