V004-1255 Screening compound: 7-chloro-3-(4-nitrophenyl)-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

V004-1255 Screening compound: 7-chloro-3-(4-nitrophenyl)-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione
V004-1255 Screening compound: 7-chloro-3-(4-nitrophenyl)-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1255
7-chloro-3-(4-nitrophenyl)-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

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

V004-1255

Molecular Formula

C20H17ClN4O5 (C20 H17 ClN4 O5)

Compound Name

7-chloro-3-(4-nitrophenyl)-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-2,4-dione

IUPAC name

7-chloro-3-(4-nitrophenyl)-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1234-tetrahydroquinazoline-24-dione

SMILES

[O-][N+](c(cc1)ccc1N(C(c(ccc(Cl)c1)c1N1CC(N2CCCC2)=O)=O)C1=O)=O

InChI

InChI=1S/C20H17ClN4O5/c21-13-3-8-16-17(11-13)23(12-18(26)22-9-1-2-10-22)20(28)24(19(16)27)14-4-6-15(7-5-14)25(29)30/h3-8,11H,1-2,9-10,12H2

InChI Key

BLOBUBOUJJINJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19788739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.83

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.469

Distribution Coefficient, logD

2.469

Water Solubility, LogSw

-3.34

Polar Surface Area

80.795

Acid Dissociation Constant (pKa)

23.47

Base Dissociation Constant (pKb)

-0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V004-1255 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 V004-1255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1255?
Check Price and Availability of V004-1255, 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 V004-1255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1255
  • 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 V004-1255 available by request