C201-0300 Screening compound: [(2Z)-3-[(3,4-difluorophenyl)carbamoyl]-2H-chromen-2-ylidene]amino butanoate

C201-0300 Screening compound: [(2Z)-3-[(3,4-difluorophenyl)carbamoyl]-2H-chromen-2-ylidene]amino butanoate
C201-0300 Screening compound: [(2Z)-3-[(3,4-difluorophenyl)carbamoyl]-2H-chromen-2-ylidene]amino butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0300
[(2Z)-3-[(3,4-difluorophenyl)carbamoyl]-2H-chromen-2-ylidene]amino 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

C201-0300

Molecular Formula

C20H16F2N2O4 (C20 H16 F2 N2 O4)

Compound Name

[(2Z)-3-[(3,4-difluorophenyl)carbamoyl]-2H-chromen-2-ylidene]amino butanoate

IUPAC name

[(2Z)-3-[(34-difluorophenyl)carbamoyl]-2H-chromen-2-ylidene]amino butanoate

SMILES

CCCC(O/N=C1\Oc(cccc2)c2C=C1C(Nc(cc1)cc(F)c1F)=O)=O

InChI

InChI=1S/C20H16F2N2O4/c1-2-5-18(25)28-24-20-14(10-12-6-3-4-7-17(12)27-20)19(26)23-13-8-9-15(21)16(22)11-13/h3-4,6-11H,2,5H2,1H3,(H,23,26)

InChI Key

PPIYFMVBVWYMSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14729332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.024

Distribution Coefficient, logD

3.245

Water Solubility, LogSw

-4.15

Polar Surface Area

62.565

Acid Dissociation Constant (pKa)

6.70

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

C201-0300 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with C201-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0300?
Check Price and Availability of C201-0300, 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 C201-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0300
  • 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 C201-0300 available by request