V014-5738 Screening compound: ethyl 4-(2-methoxyphenyl)-1-methyl-6-({3-methyl-4-[(propylamino)carbonyl]piperazino}methyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

V014-5738 Screening compound: ethyl 4-(2-methoxyphenyl)-1-methyl-6-({3-methyl-4-[(propylamino)carbonyl]piperazino}methyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
V014-5738 Screening compound: ethyl 4-(2-methoxyphenyl)-1-methyl-6-({3-methyl-4-[(propylamino)carbonyl]piperazino}methyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-5738
ethyl 4-(2-methoxyphenyl)-1-methyl-6-({3-methyl-4-[(propylamino)carbonyl]piperazino}methyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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

V014-5738

Molecular Formula

C25H37N5O5 (C25 H37 N5 O5)

Compound Name

ethyl 4-(2-methoxyphenyl)-1-methyl-6-({3-methyl-4-[(propylamino)carbonyl]piperazino}methyl)-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

IUPAC name

ethyl 4-(2-methoxyphenyl)-1-methyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCCNC(N1C(C)CN(CC(N(C)C(NC2c(cccc3)c3OC)=O)=C2C(OCC)=O)CC1)=O

InChI

InChI=1S/C25H37N5O5/c1-6-12-26-24(32)30-14-13-29(15-17(30)3)16-19-21(23(31)35-7-2)22(27-25(33)28(19)4)18-10-8-9-11-20(18)34-5/h8-11,17,22H,6-7,12-16H2,1-5H3,(H,26,32)(H,27,33)

InChI Key

AKPZRYUYBZDJCI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19816147

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

487.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.730

Distribution Coefficient, logD

0.563

Water Solubility, LogSw

-3.08

Polar Surface Area

86.084

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

8.03

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

56.00

V014-5738 in Drug Discovery

Included in Screening Libraries

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V014-5738 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5738?
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What is the minimum amount of V014-5738 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5738
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5738
  • 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 V014-5738 available by request