V013-3150 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-methoxyphenyl)amino]-2-phenylpyrimidine-5-carboxamide

V013-3150 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-methoxyphenyl)amino]-2-phenylpyrimidine-5-carboxamide
V013-3150 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-methoxyphenyl)amino]-2-phenylpyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-3150
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-methoxyphenyl)amino]-2-phenylpyrimidine-5-carboxamide

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

V013-3150

Molecular Formula

C28H28N4O4 (C28 H28 N4 O4)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(3-methoxyphenyl)amino]-2-phenylpyrimidine-5-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-4-[(3-methoxyphenyl)amino]-2-phenylpyrimidine-5-carboxamide

SMILES

COc1cccc(Nc(nc(-c2ccccc2)nc2)c2C(NCCc(cc2)cc(OC)c2OC)=O)c1

InChI

InChI=1S/C28H28N4O4/c1-34-22-11-7-10-21(17-22)31-27-23(18-30-26(32-27)20-8-5-4-6-9-20)28(33)29-15-14-19-12-13-24(35-2)25(16-19)36-3/h4-13,16-18H,14-15H2,1-3H3,(H,29,33)(H,30,31,32)

InChI Key

GEILCACBQYYSCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19973597

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.605

Distribution Coefficient, logD

4.601

Water Solubility, LogSw

-4.32

Polar Surface Area

75.671

Acid Dissociation Constant (pKa)

13.75

Base Dissociation Constant (pKb)

5.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

V013-3150 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V013-3150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-3150?
Check Price and Availability of V013-3150, 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 V013-3150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-3150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-3150
  • 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 V013-3150 available by request