8012-9013 Screening compound: 4-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)formamido]butanoate

8012-9013 Screening compound: 4-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)formamido]butanoate
8012-9013 Screening compound: 4-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)formamido]butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-9013
4-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)formamido]butanoate

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

8012-9013

Molecular Formula

C9H10N3O5 (C9 H10 N3 O5)

Compound Name

4-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)formamido]butanoate

IUPAC name

4-[(26-dioxo-1236-tetrahydropyrimidin-4-yl)formamido]butanoate

SMILES

[O-]C(CCCNC(C(NC(N1)=O)=CC1=O)=O)=O

InChI

InChI=1S/C9H11N3O5/c13-6-4-5(11-9(17)12-6)8(16)10-3-1-2-7(14)15/h4H,1-3H2,(H,10,16)(H,14,15)(H2,11,12,13,17)/p-1

InChI Key

YXJAAHGOKMAUFI-UHFFFAOYSA-M

MDL Number (MFCD)

MFCD03134111

Chemical and Physical Properties

Saltdata

Na+

Molecular Weight

240.2

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-1.675

Distribution Coefficient, logD

-3.907

Water Solubility, LogSw

-1.32

Polar Surface Area

102.332

Acid Dissociation Constant (pKa)

5.17

Base Dissociation Constant (pKb)

1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8012-9013 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8012-9013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-9013?
Check Price and Availability of 8012-9013, 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 8012-9013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-9013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-9013
  • 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 8012-9013 available by request