G964-0033 Screening compound: ethyl 4-({4-[(morpholin-4-yl)methyl]piperidine-1-carbonyl}amino)benzoate

G964-0033 Screening compound: ethyl 4-({4-[(morpholin-4-yl)methyl]piperidine-1-carbonyl}amino)benzoate
G964-0033 Screening compound: ethyl 4-({4-[(morpholin-4-yl)methyl]piperidine-1-carbonyl}amino)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G964-0033
ethyl 4-({4-[(morpholin-4-yl)methyl]piperidine-1-carbonyl}amino)benzoate

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

G964-0033

Molecular Formula

C20H29N3O4 (C20 H29 N3 O4)

Compound Name

ethyl 4-({4-[(morpholin-4-yl)methyl]piperidine-1-carbonyl}amino)benzoate

IUPAC name

ethyl 4-({4-[(morpholin-4-yl)methyl]piperidine-1-carbonyl}amino)benzoate

SMILES

CCOC(c(cc1)ccc1NC(N1CCC(CN2CCOCC2)CC1)=O)=O

InChI

InChI=1S/C20H29N3O4/c1-2-27-19(24)17-3-5-18(6-4-17)21-20(25)23-9-7-16(8-10-23)15-22-11-13-26-14-12-22/h3-6,16H,2,7-15H2,1H3,(H,21,25)

InChI Key

NBNLTAPKKBFEIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15077331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.620

Distribution Coefficient, logD

1.889

Water Solubility, LogSw

-2.91

Polar Surface Area

58.102

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

8.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

G964-0033 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G964-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G964-0033?
Check Price and Availability of G964-0033, 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 G964-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G964-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G964-0033
  • 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 G964-0033 available by request