V014-9851 Screening compound: 6-chloro-2-(2-methoxynaphthalen-1-yl)-3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinazolin-4-one

V014-9851 Screening compound: 6-chloro-2-(2-methoxynaphthalen-1-yl)-3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinazolin-4-one
V014-9851 Screening compound: 6-chloro-2-(2-methoxynaphthalen-1-yl)-3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-9851
6-chloro-2-(2-methoxynaphthalen-1-yl)-3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinazolin-4-one

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

V014-9851

Molecular Formula

C28H23ClN2O3 (C28 H23 ClN2 O3)

Compound Name

6-chloro-2-(2-methoxynaphthalen-1-yl)-3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydroquinazolin-4-one

IUPAC name

6-chloro-2-(2-methoxynaphthalen-1-yl)-3-[2-(4-methoxyphenyl)ethyl]-34-dihydroquinazolin-4-one

SMILES

COc1ccc(CCN(C(c(c2ccccc2cc2)c2OC)=Nc(cc2)c3cc2Cl)C3=O)cc1

InChI

InChI=1S/C28H23ClN2O3/c1-33-21-11-7-18(8-12-21)15-16-31-27(30-24-13-10-20(29)17-23(24)28(31)32)26-22-6-4-3-5-19(22)9-14-25(26)34-2/h3-14,17H,15-16H2,1-2H3

InChI Key

AGWTWVRCZIAWBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19964513

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.95

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.791

Distribution Coefficient, logD

5.791

Water Solubility, LogSw

-6.42

Polar Surface Area

40.231

Acid Dissociation Constant (pKa)

26.13

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

V014-9851 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V014-9851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-9851?
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What is the minimum amount of V014-9851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-9851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-9851
  • 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 V014-9851 available by request