3651-6300 Screening compound: 2-(3-methylphenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine

3651-6300 Screening compound: 2-(3-methylphenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
3651-6300 Screening compound: 2-(3-methylphenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3651-6300
2-(3-methylphenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine

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

3651-6300

Molecular Formula

C22H16F3N3 (C22 H16 F3 N3)

Compound Name

2-(3-methylphenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine

IUPAC name

2-(3-methylphenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine

SMILES

Cc1cccc(-c2nc3ccccc3c(Nc3cccc(C(F)(F)F)c3)n2)c1

InChI

InChI=1S/C22H16F3N3/c1-14-6-4-7-15(12-14)20-27-19-11-3-2-10-18(19)21(28-20)26-17-9-5-8-16(13-17)22(23,24)25/h2-13H,1H3,(H,26,27,28)

InChI Key

MLIQAUMIDPLESA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02643615

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.433

Distribution Coefficient, logD

7.302

Water Solubility, LogSw

-6.32

Polar Surface Area

27.805

Acid Dissociation Constant (pKa)

16.88

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

3651-6300 in Drug Discovery

Included in Screening Libraries

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

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3651-6300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3651-6300?
Check Price and Availability of 3651-6300, 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 3651-6300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3651-6300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3651-6300
  • 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 3651-6300 available by request