1901-0023 Screening compound: 2-ethoxyethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

1901-0023 Screening compound: 2-ethoxyethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
1901-0023 Screening compound: 2-ethoxyethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1901-0023
2-ethoxyethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

1901-0023

Molecular Formula

C17H20Cl2N2O4 (C17 H20 Cl2 N2 O4)

Compound Name

2-ethoxyethyl 4-(3,4-dichlorophenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

2-ethoxyethyl 4-(34-dichlorophenyl)-16-dimethyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOCCOC(C(C(c(cc1)cc(Cl)c1Cl)N1)=C(C)N(C)C1=O)=O

InChI

InChI=1S/C17H20Cl2N2O4/c1-4-24-7-8-25-16(22)14-10(2)21(3)17(23)20-15(14)11-5-6-12(18)13(19)9-11/h5-6,9,15H,4,7-8H2,1-3H3,(H,20,23)/t15-/m0/s1

InChI Key

UUNRYCYHJGCVCY-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD00816335

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.296

Distribution Coefficient, logD

3.288

Water Solubility, LogSw

-3.68

Polar Surface Area

56.700

Acid Dissociation Constant (pKa)

9.15

Base Dissociation Constant (pKb)

-4.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

1901-0023 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 1901-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1901-0023?
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What is the minimum amount of 1901-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1901-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1901-0023
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1901-0023 available by request