L878-0546 Screening compound: N-(3-fluorophenyl)-2-(2-oxo-4-{[(thiophen-2-yl)methyl]amino}-1,2-dihydroquinazolin-1-yl)acetamide

L878-0546 Screening compound: N-(3-fluorophenyl)-2-(2-oxo-4-{[(thiophen-2-yl)methyl]amino}-1,2-dihydroquinazolin-1-yl)acetamide
L878-0546 Screening compound: N-(3-fluorophenyl)-2-(2-oxo-4-{[(thiophen-2-yl)methyl]amino}-1,2-dihydroquinazolin-1-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L878-0546
N-(3-fluorophenyl)-2-(2-oxo-4-{[(thiophen-2-yl)methyl]amino}-1,2-dihydroquinazolin-1-yl)acetamide

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

L878-0546

Molecular Formula

C21H17FN4O2S (C21 H17 FN4 O2 S)

Compound Name

N-(3-fluorophenyl)-2-(2-oxo-4-{[(thiophen-2-yl)methyl]amino}-1,2-dihydroquinazolin-1-yl)acetamide

IUPAC name

N-(3-fluorophenyl)-2-(2-oxo-4-{[(thiophen-2-yl)methyl]amino}-12-dihydroquinazolin-1-yl)acetamide

SMILES

O=C(CN(c(cccc1)c1C(NCc1cccs1)=N1)C1=O)Nc1cc(F)ccc1

InChI

InChI=1S/C21H17FN4O2S/c22-14-5-3-6-15(11-14)24-19(27)13-26-18-9-2-1-8-17(18)20(25-21(26)28)23-12-16-7-4-10-29-16/h1-11H,12-13H2,(H,24,27)(H,23,25,28)

InChI Key

GUSHSJUCPSRHNF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27483630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.376

Distribution Coefficient, logD

3.308

Water Solubility, LogSw

-3.92

Polar Surface Area

59.344

Acid Dissociation Constant (pKa)

10.90

Base Dissociation Constant (pKb)

6.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

L878-0546 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L878-0546 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L878-0546?
Check Price and Availability of L878-0546, 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 L878-0546 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L878-0546
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L878-0546
  • 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 L878-0546 available by request