Y021-0096 Screening compound: 6-amino-2-[(2,4-dichlorophenyl)amino]-3,4-dihydropyrimidin-4-one

Y021-0096 Screening compound: 6-amino-2-[(2,4-dichlorophenyl)amino]-3,4-dihydropyrimidin-4-one
Y021-0096 Screening compound: 6-amino-2-[(2,4-dichlorophenyl)amino]-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-0096
6-amino-2-[(2,4-dichlorophenyl)amino]-3,4-dihydropyrimidin-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

Y021-0096

Molecular Formula

C10H8Cl2N4O (C10 H8 Cl2 N4 O)

Compound Name

6-amino-2-[(2,4-dichlorophenyl)amino]-3,4-dihydropyrimidin-4-one

IUPAC name

6-amino-2-[(24-dichlorophenyl)amino]-34-dihydropyrimidin-4-one

SMILES

NC(N=C(Nc(ccc(Cl)c1)c1Cl)N1)=CC1=O

InChI

InChI=1S/C10H8Cl2N4O/c11-5-1-2-7(6(12)3-5)14-10-15-8(13)4-9(17)16-10/h1-4H,(H4,13,14,15,16,17)

InChI Key

POCXXULHQCBCNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06754866

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.11

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.910

Distribution Coefficient, logD

1.772

Water Solubility, LogSw

-2.92

Polar Surface Area

64.040

Acid Dissociation Constant (pKa)

7.83

Base Dissociation Constant (pKb)

6.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y021-0096 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y021-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-0096?
Check Price and Availability of Y021-0096, 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 Y021-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-0096
  • 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 Y021-0096 available by request