SA99-0811 Screening compound: 4-(cyclopropylmethyl)-N1'-(2,5-dimethoxyphenyl)-[1,4'-bipiperidine]-1',4-dicarboxamide

SA99-0811 Screening compound: 4-(cyclopropylmethyl)-N1'-(2,5-dimethoxyphenyl)-[1,4'-bipiperidine]-1',4-dicarboxamide
SA99-0811 Screening compound: 4-(cyclopropylmethyl)-N1'-(2,5-dimethoxyphenyl)-[1,4'-bipiperidine]-1',4-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA99-0811
4-(cyclopropylmethyl)-N1'-(2,5-dimethoxyphenyl)-[1,4'-bipiperidine]-1',4-dicarboxamide

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

SA99-0811

Molecular Formula

C24H36N4O4 (C24 H36 N4 O4)

Compound Name

4-(cyclopropylmethyl)-N1'-(2,5-dimethoxyphenyl)-[1,4'-bipiperidine]-1',4-dicarboxamide

IUPAC name

4-(cyclopropylmethyl)-N1'-(25-dimethoxyphenyl)-[14'-bipiperidine]-1'4-dicarboxamide

SMILES

COc(cc1)cc(NC(N(CC2)CCC2N(CC2)CCC2(CC2CC2)C(N)=O)=O)c1OC

InChI

InChI=1S/C24H36N4O4/c1-31-19-5-6-21(32-2)20(15-19)26-23(30)28-11-7-18(8-12-28)27-13-9-24(10-14-27,22(25)29)16-17-3-4-17/h5-6,15,17-18H,3-4,7-14,16H2,1-2H3,(H2,25,29)(H,26,30)

InChI Key

REMCYEKGZPPCRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32244516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.727

Distribution Coefficient, logD

-0.725

Water Solubility, LogSw

-3.34

Polar Surface Area

77.588

Acid Dissociation Constant (pKa)

11.60

Base Dissociation Constant (pKb)

10.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

SA99-0811 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SA99-0811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA99-0811?
Check Price and Availability of SA99-0811, 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 SA99-0811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA99-0811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA99-0811
  • 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 SA99-0811 available by request