Y041-1333 Screening compound: N'-[3-(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)propanoyl]-4-nitrobenzohydrazide

Y041-1333 Screening compound: N'-[3-(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)propanoyl]-4-nitrobenzohydrazide
Y041-1333 Screening compound: N'-[3-(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)propanoyl]-4-nitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-1333
N'-[3-(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)propanoyl]-4-nitrobenzohydrazide

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

Y041-1333

Molecular Formula

C18H15N5O6 (C18 H15 N5 O6)

Compound Name

N'-[3-(2,4-dioxo-1,2,3,4-tetrahydroquinazolin-3-yl)propanoyl]-4-nitrobenzohydrazide

IUPAC name

N'-[3-(24-dioxo-1234-tetrahydroquinazolin-3-yl)propanoyl]-4-nitrobenzohydrazide

SMILES

[O-][N+](c(cc1)ccc1C(NNC(CCN(C(c(cccc1)c1N1)=O)C1=O)=O)=O)=O

InChI

InChI=1S/C18H15N5O6/c24-15(20-21-16(25)11-5-7-12(8-6-11)23(28)29)9-10-22-17(26)13-3-1-2-4-14(13)19-18(22)27/h1-8H,9-10H2,(H,19,27)(H,20,24)(H,21,25)

InChI Key

KKOHNNVPYFEGKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09852066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.35

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.501

Distribution Coefficient, logD

1.497

Water Solubility, LogSw

-2.45

Polar Surface Area

125.095

Acid Dissociation Constant (pKa)

9.50

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with Y041-1333 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-1333?
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What is the minimum amount of Y041-1333 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-1333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-1333
  • 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 Y041-1333 available by request