V001-0891 Screening compound: N-[5-(diethylamino)pentan-2-yl]-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-4-phenylbutanamide

V001-0891 Screening compound: N-[5-(diethylamino)pentan-2-yl]-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-4-phenylbutanamide
V001-0891 Screening compound: N-[5-(diethylamino)pentan-2-yl]-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-4-phenylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-0891
N-[5-(diethylamino)pentan-2-yl]-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-4-phenylbutanamide

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

V001-0891

Molecular Formula

C35H45N3O (C35 H45 N3 O)

Compound Name

N-[5-(diethylamino)pentan-2-yl]-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-4-phenylbutanamide

IUPAC name

N-[5-(diethylamino)pentan-2-yl]-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-4-phenylbutanamide

SMILES

CCN(CC)CCCC(C)NC(CC(Cc1ccccc1)c1cn(Cc2ccc(C)cc2)c2c1cccc2)=O

InChI

InChI=1S/C35H45N3O/c1-5-37(6-2)22-12-13-28(4)36-35(39)24-31(23-29-14-8-7-9-15-29)33-26-38(34-17-11-10-16-32(33)34)25-30-20-18-27(3)19-21-30/h7-11,14-21,26,28,31H,5-6,12-13,22-25H2,1-4H3,(H,36,39)

InChI Key

UWZFXCXFKLKDPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19778471

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

523.76

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.510

Distribution Coefficient, logD

4.375

Water Solubility, LogSw

-5.73

Polar Surface Area

29.023

Acid Dissociation Constant (pKa)

13.53

Base Dissociation Constant (pKb)

10.54

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.00

V001-0891 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 V001-0891 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-0891?
Check Price and Availability of V001-0891, 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 V001-0891 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-0891
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-0891
  • 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 V001-0891 available by request