V019-4815 Screening compound: ethyl 4-(3-chlorophenyl)-6-{[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V019-4815 Screening compound: ethyl 4-(3-chlorophenyl)-6-{[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V019-4815 Screening compound: ethyl 4-(3-chlorophenyl)-6-{[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-4815
ethyl 4-(3-chlorophenyl)-6-{[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-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

V019-4815

Molecular Formula

C27H31ClN4O4S (C27 H31 ClN4 O4 S)

Compound Name

ethyl 4-(3-chlorophenyl)-6-{[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 4-(3-chlorophenyl)-6-{[3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c1cccc(Cl)c1)N1)=C(CN(CC2)CC(C)N2C(c2cccs2)=O)N(CC=C)C1=O)=O

InChI

InChI=1S/C27H31ClN4O4S/c1-4-11-32-21(17-30-12-13-31(18(3)16-30)25(33)22-10-7-14-37-22)23(26(34)36-5-2)24(29-27(32)35)19-8-6-9-20(28)15-19/h4,6-10,14-15,18,24H,1,5,11-13,16-17H2,2-3H3,(H,29,35)

InChI Key

YGQWRPBNSZUKPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19809427

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

543.09

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.260

Distribution Coefficient, logD

3.913

Water Solubility, LogSw

-4.42

Polar Surface Area

69.428

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.04

References: we are preparing a list of scientific research reports with V019-4815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-4815?
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What is the minimum amount of V019-4815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-4815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-4815
  • 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 V019-4815 available by request