E200-0218 Screening compound: methyl 4-[3-(4-ethoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-amido]benzoate
Chemical Structure Depiction of ChemDiv screening compound E200-0218
methyl 4-[3-(4-ethoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-amido]benzoate
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
E200-0218
Molecular Formula
C21H19N3O6 (C21 H19 N3 O6)
Compound Name
methyl 4-[3-(4-ethoxyphenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-amido]benzoate
IUPAC name
methyl 4-[3-(4-ethoxyphenyl)-24-dioxo-1234-tetrahydropyrimidine-5-amido]benzoate
SMILES
CCOc(cc1)ccc1N(C(C(C(Nc(cc1)ccc1C(OC)=O)=O)=CN1)=O)C1=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.4
Hydrogen Bond Acceptors Count
10.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
9
Partition Coefficient, logP
2.621
Distribution Coefficient, logD
2.091
Water Solubility, LogSw
-3.09
Polar Surface Area
91.146
Acid Dissociation Constant (pKa)
6.59
Base Dissociation Constant (pKb)
-2.92
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
14.30
E200-0218 in Drug Discovery
Included in Screening Libraries
C-Met Library (15277 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with E200-0218 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)