V010-4949 Screening compound: 4-(3,4-difluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-1H-indol-5-yl N,N-diethylcarbamate

V010-4949 Screening compound: 4-(3,4-difluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-1H-indol-5-yl N,N-diethylcarbamate
V010-4949 Screening compound: 4-(3,4-difluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-1H-indol-5-yl N,N-diethylcarbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-4949
4-(3,4-difluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-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

V010-4949

Molecular Formula

C28H28F2N2O4 (C28 H28 F2 N2 O4)

Compound Name

4-(3,4-difluorophenyl)-1-[(3,5-dimethoxyphenyl)methyl]-1H-indol-5-yl N,N-diethylcarbamate

IUPAC name

4-(34-difluorophenyl)-1-[(35-dimethoxyphenyl)methyl]-1H-indol-5-yl NN-diethylcarbamate

SMILES

CCN(CC)C(Oc(ccc1c2ccn1Cc1cc(OC)cc(OC)c1)c2-c(cc1)cc(F)c1F)=O

InChI

InChI=1S/C28H28F2N2O4/c1-5-31(6-2)28(33)36-26-10-9-25-22(27(26)19-7-8-23(29)24(30)15-19)11-12-32(25)17-18-13-20(34-3)16-21(14-18)35-4/h7-16H,5-6,17H2,1-4H3

InChI Key

LSSKJHWIONACQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19947304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.316

Distribution Coefficient, logD

6.316

Water Solubility, LogSw

-5.75

Polar Surface Area

38.860

Acid Dissociation Constant (pKa)

27.27

Base Dissociation Constant (pKb)

-0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V010-4949 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V010-4949 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-4949?
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What is the minimum amount of V010-4949 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-4949
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-4949
  • 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 V010-4949 available by request