C301-7125 Screening compound: N-{2,4-bis[(4-ethoxyphenyl)amino]-6-methylpyrimidin-5-yl}-2-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound C301-7125
N-{2,4-bis[(4-ethoxyphenyl)amino]-6-methylpyrimidin-5-yl}-2-(4-methoxyphenyl)acetamide
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
C301-7125
Molecular Formula
C30H33N5O4 (C30 H33 N5 O4)
Compound Name
N-{2,4-bis[(4-ethoxyphenyl)amino]-6-methylpyrimidin-5-yl}-2-(4-methoxyphenyl)acetamide
IUPAC name
N-{24-bis[(4-ethoxyphenyl)amino]-6-methylpyrimidin-5-yl}-2-(4-methoxyphenyl)acetamide
SMILES
CCOc(cc1)ccc1Nc(nc(Nc(cc1)ccc1OCC)nc1C)c1NC(Cc(cc1)ccc1OC)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
527.62
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
13.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
5.791
Distribution Coefficient, logD
5.365
Water Solubility, LogSw
-5.51
Polar Surface Area
82.258
Acid Dissociation Constant (pKa)
10.33
Base Dissociation Constant (pKb)
7.62
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.30
C301-7125 in Drug Discovery
Included in Screening Libraries
Chelators targeting matrix metalloproteinases library (8930 compounds)
Targeted Diversity Library (40567 compounds)
Antibacterial Compounds Library (13827 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Infections
- Immune system
- animal
- Proteases
References: we are preparing a list of scientific research reports with C301-7125 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)