1473-0587 Screening compound: 3-[(4-nitrophenyl)carbamoyl]propanoic acid

1473-0587 Screening compound: 3-[(4-nitrophenyl)carbamoyl]propanoic acid
1473-0587 Screening compound: 3-[(4-nitrophenyl)carbamoyl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1473-0587
3-[(4-nitrophenyl)carbamoyl]propanoic acid

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

1473-0587

Molecular Formula

C10H10N2O5 (C10 H10 N2 O5)

Compound Name

3-[(4-nitrophenyl)carbamoyl]propanoic acid

IUPAC name

3-[(4-nitrophenyl)carbamoyl]propanoic acid

SMILES

[O-][N+](c(cc1)ccc1NC(CCC(O)=O)=O)=O

InChI

InChI=1S/C10H10N2O5/c13-9(5-6-10(14)15)11-7-1-3-8(4-2-7)12(16)17/h1-4H,5-6H2,(H,11,13)(H,14,15)

InChI Key

TYVJAVSCQNUKPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00031339

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

238.2

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.715

Distribution Coefficient, logD

-2.234

Water Solubility, LogSw

-2.05

Polar Surface Area

85.153

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

-2.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

1473-0587 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1473-0587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1473-0587?
Check Price and Availability of 1473-0587, 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 1473-0587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1473-0587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1473-0587
  • 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 1473-0587 available by request