L722-0517 Screening compound: N-(CYCLOHEXYLMETHYL)-6-ACETAMIDO-3,4-DIHYDRO-2H-1-BENZOPYRAN-3-CARBOXAMIDE

L722-0517 Screening compound: N-(CYCLOHEXYLMETHYL)-6-ACETAMIDO-3,4-DIHYDRO-2H-1-BENZOPYRAN-3-CARBOXAMIDE
L722-0517 Screening compound: N-(CYCLOHEXYLMETHYL)-6-ACETAMIDO-3,4-DIHYDRO-2H-1-BENZOPYRAN-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound L722-0517
N-(CYCLOHEXYLMETHYL)-6-ACETAMIDO-3,4-DIHYDRO-2H-1-BENZOPYRAN-3-CARBOXAMIDE

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

L722-0517

Molecular Formula

C19H26N2O3 (C19 H26 N2 O3)

Compound Name

N-(CYCLOHEXYLMETHYL)-6-ACETAMIDO-3,4-DIHYDRO-2H-1-BENZOPYRAN-3-CARBOXAMIDE

IUPAC name

N-(cyclohexylmethyl)-6-acetamido-34-dihydro-2H-1-benzopyran-3-carboxamide

SMILES

CC(Nc(cc1)cc(C2)c1OCC2C(NCC1CCCCC1)=O)=O

InChI

InChI=1S/C19H26N2O3/c1-13(22)21-17-7-8-18-15(10-17)9-16(12-24-18)19(23)20-11-14-5-3-2-4-6-14/h7-8,10,14,16H,2-6,9,11-12H2,1H3,(H,20,23)(H,21,22)/t16-/m0/s1

InChI Key

VBGFJKKKLPVUQI-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27473183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.069

Distribution Coefficient, logD

3.069

Water Solubility, LogSw

-3.23

Polar Surface Area

56.476

Acid Dissociation Constant (pKa)

12.58

Base Dissociation Constant (pKb)

1.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.90

L722-0517 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L722-0517 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L722-0517?
Check Price and Availability of L722-0517, 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 L722-0517 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L722-0517
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L722-0517
  • 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 L722-0517 available by request