P574-0994 Screening compound: 2-amino-3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-methyl-3,4-dihydropyrimidin-4-one

P574-0994 Screening compound: 2-amino-3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-methyl-3,4-dihydropyrimidin-4-one
P574-0994 Screening compound: 2-amino-3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-methyl-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound P574-0994
2-amino-3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-methyl-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

P574-0994

Molecular Formula

C15H16N4O2 (C15 H16 N4 O2)

Compound Name

2-amino-3-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-methyl-3,4-dihydropyrimidin-4-one

IUPAC name

2-amino-3-[2-(23-dihydro-1H-indol-1-yl)-2-oxoethyl]-6-methyl-34-dihydropyrimidin-4-one

SMILES

CC(N=C(N)N1CC(N(CC2)c3c2cccc3)=O)=CC1=O

InChI

InChI=1S/C15H16N4O2/c1-10-8-13(20)19(15(16)17-10)9-14(21)18-7-6-11-4-2-3-5-12(11)18/h2-5,8H,6-7,9H2,1H3,(H2,16,17)

InChI Key

XBNKMBGBUFGRMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27604985

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.189

Distribution Coefficient, logD

0.189

Water Solubility, LogSw

-1.51

Polar Surface Area

61.505

Acid Dissociation Constant (pKa)

14.17

Base Dissociation Constant (pKb)

1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.67

P574-0994 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with P574-0994 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P574-0994?
Check Price and Availability of P574-0994, 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 P574-0994 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P574-0994
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P574-0994
  • 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 P574-0994 available by request