V016-9052 Screening compound: ethyl 1-ethyl-6-{[4-(ethylcarbamoyl)piperazin-1-yl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V016-9052 Screening compound: ethyl 1-ethyl-6-{[4-(ethylcarbamoyl)piperazin-1-yl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V016-9052 Screening compound: ethyl 1-ethyl-6-{[4-(ethylcarbamoyl)piperazin-1-yl]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-9052
ethyl 1-ethyl-6-{[4-(ethylcarbamoyl)piperazin-1-yl]methyl}-4-(4-methoxyphenyl)-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

V016-9052

Molecular Formula

C24H35N5O5 (C24 H35 N5 O5)

Compound Name

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

IUPAC name

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

SMILES

CCNC(N1CCN(CC(N(CC)C(NC2c(cc3)ccc3OC)=O)=C2C(OCC)=O)CC1)=O

InChI

InChI=1S/C24H35N5O5/c1-5-25-23(31)28-14-12-27(13-15-28)16-19-20(22(30)34-7-3)21(26-24(32)29(19)6-2)17-8-10-18(33-4)11-9-17/h8-11,21H,5-7,12-16H2,1-4H3,(H,25,31)(H,26,32)/t21-/m1/s1

InChI Key

UOVGYMCDEPFVDG-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19813881

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

473.57

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

1.768

Distribution Coefficient, logD

-0.297

Water Solubility, LogSw

-2.38

Polar Surface Area

86.522

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.20

References: we are preparing a list of scientific research reports with V016-9052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-9052?
Check Price and Availability of V016-9052, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V016-9052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-9052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-9052
  • 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 V016-9052 available by request