8005-1542 Screening compound: 6-[(E)-({2-[(2,4-dibromophenyl)amino]acetamido}imino)methyl]-2,3-dimethoxybenzoic acid
Chemical Structure Depiction of ChemDiv screening compound 8005-1542
6-[(E)-({2-[(2,4-dibromophenyl)amino]acetamido}imino)methyl]-2,3-dimethoxybenzoic acid
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
8005-1542
Molecular Formula
C18H17Br2N3O5 (C18 H17 Br2 N3 O5)
Compound Name
6-[(E)-({2-[(2,4-dibromophenyl)amino]acetamido}imino)methyl]-2,3-dimethoxybenzoic acid
IUPAC name
6-[(E)-({2-[(24-dibromophenyl)amino]acetamido}imino)methyl]-23-dimethoxybenzoic acid
SMILES
COc(ccc(/C=N/NC(CNc(ccc(Br)c1)c1Br)=O)c1C(O)=O)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
515.16
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
4.066
Distribution Coefficient, logD
0.976
Water Solubility, LogSw
-4.32
Polar Surface Area
88.905
Acid Dissociation Constant (pKa)
4.31
Base Dissociation Constant (pKb)
0.39
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
16.70
References: we are preparing a list of scientific research reports with 8005-1542 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)