Y042-7175 Screening compound: 2-[5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl]-N~1~-(1,3-thiazol-2-yl)acetamide

Y042-7175 Screening compound: 2-[5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl]-N~1~-(1,3-thiazol-2-yl)acetamide
Y042-7175 Screening compound: 2-[5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl]-N~1~-(1,3-thiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y042-7175
2-[5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl]-N~1~-(1,3-thiazol-2-yl)acetamide

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

Y042-7175

Molecular Formula

C20H14N4O3S (C20 H14 N4 O3 S)

Compound Name

2-[5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl]-N~1~-(1,3-thiazol-2-yl)acetamide

IUPAC name

2-{511-dioxo-5H6H6aH11H-isoindolo[21-a]quinazolin-6-yl}-N-(13-thiazol-2-yl)acetamide

SMILES

O=C(CN(C(c(cccc1)c1C1=O)N1c1c2cccc1)C2=O)Nc1nccs1

InChI

InChI=1S/C20H14N4O3S/c25-16(22-20-21-9-10-28-20)11-23-17-12-5-1-2-6-13(12)19(27)24(17)15-8-4-3-7-14(15)18(23)26/h1-10,17H,11H2,(H,21,22,25)/t17-/m1/s1

InChI Key

WBCLBTZWNWUXSZ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD28349110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.151

Distribution Coefficient, logD

2.151

Water Solubility, LogSw

-3.06

Polar Surface Area

64.351

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

0.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

Y042-7175 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y042-7175 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y042-7175?
Check Price and Availability of Y042-7175, 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 Y042-7175 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y042-7175
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y042-7175
  • 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 Y042-7175 available by request