D207-0187 Screening compound: 1-[(2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid

D207-0187 Screening compound: 1-[(2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid
D207-0187 Screening compound: 1-[(2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D207-0187
1-[(2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic 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

D207-0187

Molecular Formula

C13H16N2O3 (C13 H16 N2 O3)

Compound Name

1-[(2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid

IUPAC name

1-[(2-methylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid

SMILES

Cc(cccc1)c1NC(N(CCC1)C1C(O)=O)=O

InChI

InChI=1S/C13H16N2O3/c1-9-5-2-3-6-10(9)14-13(18)15-8-4-7-11(15)12(16)17/h2-3,5-6,11H,4,7-8H2,1H3,(H,14,18)(H,16,17)/t11-/m0/s1

InChI Key

UEDXMRKTOKTYSH-NSHDSACASA-N

MDL Number (MFCD)

MFCD13276657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.845

Distribution Coefficient, logD

-2.510

Water Solubility, LogSw

-1.89

Polar Surface Area

53.478

Acid Dissociation Constant (pKa)

4.05

Base Dissociation Constant (pKb)

0.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.50

D207-0187 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with D207-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D207-0187?
Check Price and Availability of D207-0187, 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 D207-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D207-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D207-0187
  • 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 D207-0187 available by request