2119-2691 Screening compound: cyclopentyl 4-(3-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

2119-2691 Screening compound: cyclopentyl 4-(3-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2119-2691 Screening compound: cyclopentyl 4-(3-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2119-2691
cyclopentyl 4-(3-chlorophenyl)-6-methyl-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

2119-2691

Molecular Formula

C17H19ClN2O3 (C17 H19 ClN2 O3)

Compound Name

cyclopentyl 4-(3-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

cyclopentyl 4-(3-chlorophenyl)-6-methyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CC(NC(NC1c2cccc(Cl)c2)=O)=C1C(OC1CCCC1)=O

InChI

InChI=1S/C17H19ClN2O3/c1-10-14(16(21)23-13-7-2-3-8-13)15(20-17(22)19-10)11-5-4-6-12(18)9-11/h4-6,9,13,15H,2-3,7-8H2,1H3,(H2,19,20,22)/t15-/m0/s1

InChI Key

SABIVXNGVIKWBB-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD01193337

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.8

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.016

Distribution Coefficient, logD

2.866

Water Solubility, LogSw

-3.48

Polar Surface Area

56.141

Acid Dissociation Constant (pKa)

7.78

Base Dissociation Constant (pKb)

-4.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.20

2119-2691 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2119-2691 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2119-2691?
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What is the minimum amount of 2119-2691 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2119-2691
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2119-2691
  • 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 2119-2691 available by request