V004-5822 Screening compound: ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(4-ethylbenzamido)-1H-indol-1-yl)acetate

V004-5822 Screening compound: ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(4-ethylbenzamido)-1H-indol-1-yl)acetate
V004-5822 Screening compound: ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(4-ethylbenzamido)-1H-indol-1-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-5822
ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(4-ethylbenzamido)-1H-indol-1-yl)acetate

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

V004-5822

Molecular Formula

C30H35N3O5 (C30 H35 N3 O5)

Compound Name

ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(4-ethylbenzamido)-1H-indol-1-yl)acetate

IUPAC name

ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(4-ethylbenzamido)-1H-indol-1-yl)acetate

SMILES

CCCN(CC1CC1)C(C(c1cn(CC(OCC)=O)c(cc2)c1cc2NC(c1ccc(CC)cc1)=O)=O)=O

InChI

InChI=1S/C30H35N3O5/c1-4-15-32(17-21-7-8-21)30(37)28(35)25-18-33(19-27(34)38-6-3)26-14-13-23(16-24(25)26)31-29(36)22-11-9-20(5-2)10-12-22/h9-14,16,18,21H,4-8,15,17,19H2,1-3H3,(H,31,36)

InChI Key

BYVIMUAIMRSEAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19944894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

517.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.348

Distribution Coefficient, logD

5.348

Water Solubility, LogSw

-5.38

Polar Surface Area

75.943

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V004-5822 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Anti-HIV1 Library (19540 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V004-5822 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-5822?
Check Price and Availability of V004-5822, 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 V004-5822 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-5822
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-5822
  • 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 V004-5822 available by request