V021-0287 Screening compound: 1-[(2-chlorophenyl)methyl]-4-(2,2,3,3-tetrafluoropropanamido)-1H-indol-5-yl N,N-diethylcarbamate

V021-0287 Screening compound: 1-[(2-chlorophenyl)methyl]-4-(2,2,3,3-tetrafluoropropanamido)-1H-indol-5-yl N,N-diethylcarbamate
V021-0287 Screening compound: 1-[(2-chlorophenyl)methyl]-4-(2,2,3,3-tetrafluoropropanamido)-1H-indol-5-yl N,N-diethylcarbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-0287
1-[(2-chlorophenyl)methyl]-4-(2,2,3,3-tetrafluoropropanamido)-1H-indol-5-yl N,N-diethylcarbamate

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

V021-0287

Molecular Formula

C23H22ClF4N3O3 (C23 H22 ClF4 N3 O3)

Compound Name

1-[(2-chlorophenyl)methyl]-4-(2,2,3,3-tetrafluoropropanamido)-1H-indol-5-yl N,N-diethylcarbamate

IUPAC name

1-[(2-chlorophenyl)methyl]-4-(2233-tetrafluoropropanamido)-1H-indol-5-yl NN-diethylcarbamate

SMILES

CCN(CC)C(Oc(ccc1c2ccn1Cc(cccc1)c1Cl)c2NC(C(C(F)F)(F)F)=O)=O

InChI

InChI=1S/C23H22ClF4N3O3/c1-3-30(4-2)22(33)34-18-10-9-17-15(19(18)29-21(32)23(27,28)20(25)26)11-12-31(17)13-14-7-5-6-8-16(14)24/h5-12,20H,3-4,13H2,1-2H3,(H,29,32)

InChI Key

POLBQLDSQGPQOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19947897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.845

Distribution Coefficient, logD

4.827

Water Solubility, LogSw

-4.90

Polar Surface Area

46.011

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

V021-0287 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Indole Derivatives (10091 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V021-0287 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-0287?
Check Price and Availability of V021-0287, 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 V021-0287 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-0287
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-0287
  • 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 V021-0287 available by request