3401-5475 Screening compound: 2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl 4-butoxybenzoate

3401-5475 Screening compound: 2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl 4-butoxybenzoate
3401-5475 Screening compound: 2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl 4-butoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3401-5475
2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl 4-butoxybenzoate

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

3401-5475

Molecular Formula

C20H20N2O4 (C20 H20 N2 O4)

Compound Name

2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl 4-butoxybenzoate

IUPAC name

2-methyl-4-oxo-34-dihydroquinazolin-3-yl 4-butoxybenzoate

SMILES

CCCCOc(cc1)ccc1C(ON(C(C)=Nc1c2cccc1)C2=O)=O

InChI

InChI=1S/C20H20N2O4/c1-3-4-13-25-16-11-9-15(10-12-16)20(24)26-22-14(2)21-18-8-6-5-7-17(18)19(22)23/h5-12H,3-4,13H2,1-2H3

InChI Key

LDEDPTGZOZEJRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02087656

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.366

Distribution Coefficient, logD

3.366

Water Solubility, LogSw

-3.73

Polar Surface Area

54.704

Acid Dissociation Constant (pKa)

21.88

Base Dissociation Constant (pKb)

3.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

3401-5475 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3401-5475 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3401-5475?
Check Price and Availability of 3401-5475, 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 3401-5475 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3401-5475
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3401-5475
  • 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 3401-5475 available by request