V030-2213 Screening compound: 3-(4-tert-butylphenyl)-3-(1-methyl-1H-indol-3-yl)-N-[(pyridin-4-yl)methyl]propanamide

V030-2213 Screening compound: 3-(4-tert-butylphenyl)-3-(1-methyl-1H-indol-3-yl)-N-[(pyridin-4-yl)methyl]propanamide
V030-2213 Screening compound: 3-(4-tert-butylphenyl)-3-(1-methyl-1H-indol-3-yl)-N-[(pyridin-4-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-2213
3-(4-tert-butylphenyl)-3-(1-methyl-1H-indol-3-yl)-N-[(pyridin-4-yl)methyl]propanamide

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

V030-2213

Molecular Formula

C28H31N3O (C28 H31 N3 O)

Compound Name

3-(4-tert-butylphenyl)-3-(1-methyl-1H-indol-3-yl)-N-[(pyridin-4-yl)methyl]propanamide

IUPAC name

3-(4-tert-butylphenyl)-3-(1-methyl-1H-indol-3-yl)-N-[(pyridin-4-yl)methyl]propanamide

SMILES

CC(C)(C)c1ccc(C(CC(NCc2ccncc2)=O)c2cn(C)c3c2cccc3)cc1

InChI

InChI=1S/C28H31N3O/c1-28(2,3)22-11-9-21(10-12-22)24(17-27(32)30-18-20-13-15-29-16-14-20)25-19-31(4)26-8-6-5-7-23(25)26/h5-16,19,24H,17-18H2,1-4H3,(H,30,32)/t24-/m1/s1

InChI Key

GMUJMBXYXFOHET-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19777683

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

425.57

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.049

Distribution Coefficient, logD

5.046

Water Solubility, LogSw

-4.61

Polar Surface Area

36.155

Acid Dissociation Constant (pKa)

12.43

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

V030-2213 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V030-2213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-2213?
Check Price and Availability of V030-2213, 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 V030-2213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-2213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-2213
  • 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 V030-2213 available by request