V008-9506 Screening compound: ethyl 4-(3,4-dimethoxyphenyl)-6-({4-[(isopropylamino)carbonyl]piperazino}methyl)-1-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

V008-9506 Screening compound: ethyl 4-(3,4-dimethoxyphenyl)-6-({4-[(isopropylamino)carbonyl]piperazino}methyl)-1-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
V008-9506 Screening compound: ethyl 4-(3,4-dimethoxyphenyl)-6-({4-[(isopropylamino)carbonyl]piperazino}methyl)-1-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-9506
ethyl 4-(3,4-dimethoxyphenyl)-6-({4-[(isopropylamino)carbonyl]piperazino}methyl)-1-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

V008-9506

Molecular Formula

C25H37N5O6 (C25 H37 N5 O6)

Compound Name

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

IUPAC name

ethyl 4-(34-dimethoxyphenyl)-1-methyl-2-oxo-6-({4-[(propan-2-yl)carbamoyl]piperazin-1-yl}methyl)-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c(cc1)cc(OC)c1OC)N1)=C(CN(CC2)CCN2C(NC(C)C)=O)N(C)C1=O)=O

InChI

InChI=1S/C25H37N5O6/c1-7-36-23(31)21-18(15-29-10-12-30(13-11-29)25(33)26-16(2)3)28(4)24(32)27-22(21)17-8-9-19(34-5)20(14-17)35-6/h8-9,14,16,22H,7,10-13,15H2,1-6H3,(H,26,33)(H,27,32)/t22-/m1/s1

InChI Key

JPEZTSHHDSEMNZ-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD19818443

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

503.6

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.562

Distribution Coefficient, logD

-0.630

Water Solubility, LogSw

-2.30

Polar Surface Area

93.628

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

9.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.00

References: we are preparing a list of scientific research reports with V008-9506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-9506?
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What is the minimum amount of V008-9506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-9506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-9506
  • 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 V008-9506 available by request