V010-6252 Screening compound: isobutyl 4-{4-[(2,4-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

V010-6252 Screening compound: isobutyl 4-{4-[(2,4-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
V010-6252 Screening compound: isobutyl 4-{4-[(2,4-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-6252
isobutyl 4-{4-[(2,4-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-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

V010-6252

Molecular Formula

C26H29Cl2N3O4 (C26 H29 Cl2 N3 O4)

Compound Name

isobutyl 4-{4-[(2,4-dichlorobenzoyl)amino]phenyl}-6-methyl-2-oxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

IUPAC name

2-methylpropyl 4-[4-(24-dichlorobenzamido)phenyl]-6-methyl-2-oxo-1-propyl-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCCN(C(C)=C(C(c(cc1)ccc1NC(c(ccc(Cl)c1)c1Cl)=O)N1)C(OCC(C)C)=O)C1=O

InChI

InChI=1S/C26H29Cl2N3O4/c1-5-12-31-16(4)22(25(33)35-14-15(2)3)23(30-26(31)34)17-6-9-19(10-7-17)29-24(32)20-11-8-18(27)13-21(20)28/h6-11,13,15,23H,5,12,14H2,1-4H3,(H,29,32)(H,30,34)/t23-/m0/s1

InChI Key

FOANIZDJCKOEQZ-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD14240854

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

518.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.821

Distribution Coefficient, logD

5.817

Water Solubility, LogSw

-6.04

Polar Surface Area

72.108

Acid Dissociation Constant (pKa)

9.47

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.62

References: we are preparing a list of scientific research reports with V010-6252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-6252?
Check Price and Availability of V010-6252, 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 V010-6252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-6252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-6252
  • 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 V010-6252 available by request