V015-6100 Screening compound: 2-{[[2-(1H-indol-3-yl)ethyl](3-methylbenzyl)amino]methyl}-N~4~-(3-pyridylmethyl)-1,3-oxazole-4-carboxamide

V015-6100 Screening compound: 2-{[[2-(1H-indol-3-yl)ethyl](3-methylbenzyl)amino]methyl}-N~4~-(3-pyridylmethyl)-1,3-oxazole-4-carboxamide
V015-6100 Screening compound: 2-{[[2-(1H-indol-3-yl)ethyl](3-methylbenzyl)amino]methyl}-N~4~-(3-pyridylmethyl)-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-6100
2-{[[2-(1H-indol-3-yl)ethyl](3-methylbenzyl)amino]methyl}-N~4~-(3-pyridylmethyl)-1,3-oxazole-4-carboxamide

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

V015-6100

Molecular Formula

C29H29N5O2 (C29 H29 N5 O2)

Compound Name

2-{[[2-(1H-indol-3-yl)ethyl](3-methylbenzyl)amino]methyl}-N~4~-(3-pyridylmethyl)-1,3-oxazole-4-carboxamide

IUPAC name

2-({[2-(1H-indol-3-yl)ethyl][(3-methylphenyl)methyl]amino}methyl)-N-[(pyridin-3-yl)methyl]-13-oxazole-4-carboxamide

SMILES

Cc1cccc(CN(CCc2c[nH]c3c2cccc3)Cc2nc(C(NCc3cnccc3)=O)co2)c1

InChI

InChI=1S/C29H29N5O2/c1-21-6-4-7-22(14-21)18-34(13-11-24-17-31-26-10-3-2-9-25(24)26)19-28-33-27(20-36-28)29(35)32-16-23-8-5-12-30-15-23/h2-10,12,14-15,17,20,31H,11,13,16,18-19H2,1H3,(H,32,35)

InChI Key

UYCCBHQYKILIEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19829492

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

479.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.093

Distribution Coefficient, logD

4.093

Water Solubility, LogSw

-3.99

Polar Surface Area

65.865

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.69

V015-6100 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 V015-6100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-6100?
Check Price and Availability of V015-6100, 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 V015-6100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-6100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-6100
  • 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 V015-6100 available by request