V002-8397 Screening compound: 1-[3-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)BENZYL]-N,N-DIETHYL-3-PIPERIDINECARBOXAMIDE

V002-8397 Screening compound: 1-[3-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)BENZYL]-N,N-DIETHYL-3-PIPERIDINECARBOXAMIDE
V002-8397 Screening compound: 1-[3-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)BENZYL]-N,N-DIETHYL-3-PIPERIDINECARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-8397
1-[3-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)BENZYL]-N,N-DIETHYL-3-PIPERIDINECARBOXAMIDE

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

V002-8397

Molecular Formula

C22H36N4O2 (C22 H36 N4 O2)

Compound Name

1-[3-({[2-(DIMETHYLAMINO)ETHYL]AMINO}CARBONYL)BENZYL]-N,N-DIETHYL-3-PIPERIDINECARBOXAMIDE

IUPAC name

n/a

SMILES

CCN(CC)C(C1CN(Cc2cccc(C(NCCN(C)C)=O)c2)CCC1)=O

InChI

InChI=1S/C22H36N4O2/c1-5-26(6-2)22(28)20-11-8-13-25(17-20)16-18-9-7-10-19(15-18)21(27)23-12-14-24(3)4/h7,9-10,15,20H,5-6,8,11-14,16-17H2,1-4H3,(H,23,27)/t20-/m0/s1

InChI Key

AUSVBOQEEQTZCM-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19914281

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

388.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.230

Distribution Coefficient, logD

0.390

Water Solubility, LogSw

-2.14

Polar Surface Area

48.229

Acid Dissociation Constant (pKa)

11.80

Base Dissociation Constant (pKb)

8.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.60

V002-8397 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with V002-8397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-8397?
Check Price and Availability of V002-8397, 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 V002-8397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-8397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-8397
  • 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 V002-8397 available by request