2368-0169 Screening compound: (5E)-5-{[3,5-diiodo-4-(methylamino)phenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of ChemDiv screening compound 2368-0169
(5E)-5-{[3,5-diiodo-4-(methylamino)phenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
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
2368-0169
Molecular Formula
C20H17I2N3O3 (C20 H17 I2 N3 O3)
Compound Name
(5E)-5-{[3,5-diiodo-4-(methylamino)phenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
IUPAC name
(5E)-5-{[35-diiodo-4-(methylamino)phenyl]methylidene}-1-(35-dimethylphenyl)-13-diazinane-246-trione
SMILES
Cc1cc(N(C(/C(/C(N2)=O)=C/c(cc3I)cc(I)c3NC)=O)C2=O)cc(C)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
601.18
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.487
Distribution Coefficient, logD
4.471
Water Solubility, LogSw
-4.29
Polar Surface Area
62.652
Acid Dissociation Constant (pKa)
8.84
Base Dissociation Constant (pKb)
7.35
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.00
References: we are preparing a list of scientific research reports with 2368-0169 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)