2664-4265 Screening compound: methyl 3-[(2-nitrophenyl)carbamoyl]propanoate

2664-4265 Screening compound: methyl 3-[(2-nitrophenyl)carbamoyl]propanoate
2664-4265 Screening compound: methyl 3-[(2-nitrophenyl)carbamoyl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2664-4265
methyl 3-[(2-nitrophenyl)carbamoyl]propanoate

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

2664-4265

Molecular Formula

C11H12N2O5 (C11 H12 N2 O5)

Compound Name

methyl 3-[(2-nitrophenyl)carbamoyl]propanoate

IUPAC name

methyl 3-[(2-nitrophenyl)carbamoyl]propanoate

SMILES

COC(CCC(Nc(cccc1)c1[N+]([O-])=O)=O)=O

InChI

InChI=1S/C11H12N2O5/c1-18-11(15)7-6-10(14)12-8-4-2-3-5-9(8)13(16)17/h2-5H,6-7H2,1H3,(H,12,14)

InChI Key

RQZHHQQATAKKER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00446839

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

252.23

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.097

Distribution Coefficient, logD

1.071

Water Solubility, LogSw

-2.18

Polar Surface Area

76.349

Acid Dissociation Constant (pKa)

8.60

Base Dissociation Constant (pKb)

-4.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with 2664-4265 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2664-4265?
Check Price and Availability of 2664-4265, 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 2664-4265 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2664-4265
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2664-4265
  • 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 2664-4265 available by request