V014-2661 Screening compound: ethyl 1-(4-ethoxy-1-propyl-1H-indole-2-carbonyl)piperidine-3-carboxylate

V014-2661 Screening compound: ethyl 1-(4-ethoxy-1-propyl-1H-indole-2-carbonyl)piperidine-3-carboxylate
V014-2661 Screening compound: ethyl 1-(4-ethoxy-1-propyl-1H-indole-2-carbonyl)piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-2661
ethyl 1-(4-ethoxy-1-propyl-1H-indole-2-carbonyl)piperidine-3-carboxylate

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

V014-2661

Molecular Formula

C22H30N2O4 (C22 H30 N2 O4)

Compound Name

ethyl 1-(4-ethoxy-1-propyl-1H-indole-2-carbonyl)piperidine-3-carboxylate

IUPAC name

ethyl 1-(4-ethoxy-1-propyl-1H-indole-2-carbonyl)piperidine-3-carboxylate

SMILES

CCCn(c(C(N(CCC1)CC1C(OCC)=O)=O)c1)c2c1c(OCC)ccc2

InChI

InChI=1S/C22H30N2O4/c1-4-12-24-18-10-7-11-20(27-5-2)17(18)14-19(24)21(25)23-13-8-9-16(15-23)22(26)28-6-3/h7,10-11,14,16H,4-6,8-9,12-13,15H2,1-3H3/t16-/m0/s1

InChI Key

AGCMQOATVWOEAU-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19858567

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.286

Distribution Coefficient, logD

4.286

Water Solubility, LogSw

-4.24

Polar Surface Area

45.488

Acid Dissociation Constant (pKa)

22.52

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

V014-2661 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 V014-2661 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-2661?
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What is the minimum amount of V014-2661 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-2661
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-2661
  • 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 V014-2661 available by request