V008-0791 Screening compound: 1-[(2,5-dichlorophenyl)methyl]-4-(4-methylphenyl)-1H-indol-5-yl N,N-diethylcarbamate

V008-0791 Screening compound: 1-[(2,5-dichlorophenyl)methyl]-4-(4-methylphenyl)-1H-indol-5-yl N,N-diethylcarbamate
V008-0791 Screening compound: 1-[(2,5-dichlorophenyl)methyl]-4-(4-methylphenyl)-1H-indol-5-yl N,N-diethylcarbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-0791
1-[(2,5-dichlorophenyl)methyl]-4-(4-methylphenyl)-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

V008-0791

Molecular Formula

C27H26Cl2N2O2 (C27 H26 Cl2 N2 O2)

Compound Name

1-[(2,5-dichlorophenyl)methyl]-4-(4-methylphenyl)-1H-indol-5-yl N,N-diethylcarbamate

IUPAC name

1-[(25-dichlorophenyl)methyl]-4-(4-methylphenyl)-1H-indol-5-yl NN-diethylcarbamate

SMILES

CCN(CC)C(Oc(ccc1c2ccn1Cc(cc(cc1)Cl)c1Cl)c2-c1ccc(C)cc1)=O

InChI

InChI=1S/C27H26Cl2N2O2/c1-4-30(5-2)27(32)33-25-13-12-24-22(26(25)19-8-6-18(3)7-9-19)14-15-31(24)17-20-16-21(28)10-11-23(20)29/h6-16H,4-5,17H2,1-3H3

InChI Key

QRURESXHZULFBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19947420

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.750

Distribution Coefficient, logD

7.750

Water Solubility, LogSw

-6.73

Polar Surface Area

23.773

Acid Dissociation Constant (pKa)

26.88

Base Dissociation Constant (pKb)

-1.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

V008-0791 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with V008-0791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-0791?
Check Price and Availability of V008-0791, 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 V008-0791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-0791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-0791
  • 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 V008-0791 available by request