V013-9414 Screening compound: 2-[3-(3-acetylphenyl)-7-chloro-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-propylacetamide

V013-9414 Screening compound: 2-[3-(3-acetylphenyl)-7-chloro-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-propylacetamide
V013-9414 Screening compound: 2-[3-(3-acetylphenyl)-7-chloro-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-9414
2-[3-(3-acetylphenyl)-7-chloro-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-propylacetamide

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

V013-9414

Molecular Formula

C21H20ClN3O4 (C21 H20 ClN3 O4)

Compound Name

2-[3-(3-acetylphenyl)-7-chloro-2,4-dioxo-1,2,3,4-tetrahydroquinazolin-1-yl]-N-propylacetamide

IUPAC name

2-[3-(3-acetylphenyl)-7-chloro-24-dioxo-1234-tetrahydroquinazolin-1-yl]-N-propylacetamide

SMILES

CCCNC(CN(c(cc(cc1)Cl)c1C(N1c2cc(C(C)=O)ccc2)=O)C1=O)=O

InChI

InChI=1S/C21H20ClN3O4/c1-3-9-23-19(27)12-24-18-11-15(22)7-8-17(18)20(28)25(21(24)29)16-6-4-5-14(10-16)13(2)26/h4-8,10-11H,3,9,12H2,1-2H3,(H,23,27)

InChI Key

KFCRHMYELRHDEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19789023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.86

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.033

Distribution Coefficient, logD

2.033

Water Solubility, LogSw

-3.36

Polar Surface Area

69.067

Acid Dissociation Constant (pKa)

15.93

Base Dissociation Constant (pKb)

5.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with V013-9414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-9414?
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What is the minimum amount of V013-9414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-9414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-9414
  • 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 V013-9414 available by request