V028-4291 Screening compound: 3-(1-benzyl-5-nitro-1H-indol-3-yl)-N-(3-methoxypropyl)-3-phenylpropanamide

V028-4291 Screening compound: 3-(1-benzyl-5-nitro-1H-indol-3-yl)-N-(3-methoxypropyl)-3-phenylpropanamide
V028-4291 Screening compound: 3-(1-benzyl-5-nitro-1H-indol-3-yl)-N-(3-methoxypropyl)-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-4291
3-(1-benzyl-5-nitro-1H-indol-3-yl)-N-(3-methoxypropyl)-3-phenylpropanamide

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

V028-4291

Molecular Formula

C28H29N3O4 (C28 H29 N3 O4)

Compound Name

3-(1-benzyl-5-nitro-1H-indol-3-yl)-N-(3-methoxypropyl)-3-phenylpropanamide

IUPAC name

3-(1-benzyl-5-nitro-1H-indol-3-yl)-N-(3-methoxypropyl)-3-phenylpropanamide

SMILES

COCCCNC(CC(c1cn(Cc2ccccc2)c(cc2)c1cc2[N+]([O-])=O)c1ccccc1)=O

InChI

InChI=1S/C28H29N3O4/c1-35-16-8-15-29-28(32)18-24(22-11-6-3-7-12-22)26-20-30(19-21-9-4-2-5-10-21)27-14-13-23(31(33)34)17-25(26)27/h2-7,9-14,17,20,24H,8,15-16,18-19H2,1H3,(H,29,32)/t24-/m1/s1

InChI Key

WSLAMSJYDHCBMU-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19848822

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

471.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.692

Distribution Coefficient, logD

4.692

Water Solubility, LogSw

-4.38

Polar Surface Area

67.736

Acid Dissociation Constant (pKa)

14.51

Base Dissociation Constant (pKb)

0.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

V028-4291 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 V028-4291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-4291?
Check Price and Availability of V028-4291, 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 V028-4291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-4291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-4291
  • 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 V028-4291 available by request