L120-1551 Screening compound: ethyl 4-[2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]piperidine-1-carboxylate

L120-1551 Screening compound: ethyl 4-[2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]piperidine-1-carboxylate
L120-1551 Screening compound: ethyl 4-[2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L120-1551
ethyl 4-[2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]piperidine-1-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

L120-1551

Molecular Formula

C26H30ClN3O5 (C26 H30 ClN3 O5)

Compound Name

ethyl 4-[2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-amido]piperidine-1-carboxylate

IUPAC name

ethyl 4-[2-(4-chlorophenyl)-66-dimethyl-38-dioxo-235678-hexahydroisoquinoline-4-amido]piperidine-1-carboxylate

SMILES

CCOC(N(CC1)CCC1NC(C1=C(CC(C)(C)CC2=O)C2=CN(c(cc2)ccc2Cl)C1=O)=O)=O

InChI

InChI=1S/C26H30ClN3O5/c1-4-35-25(34)29-11-9-17(10-12-29)28-23(32)22-19-13-26(2,3)14-21(31)20(19)15-30(24(22)33)18-7-5-16(27)6-8-18/h5-8,15,17H,4,9-14H2,1-3H3,(H,28,32)

InChI Key

BHGKGTBBYNSPLR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27234001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.99

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.966

Distribution Coefficient, logD

2.966

Water Solubility, LogSw

-3.51

Polar Surface Area

76.113

Acid Dissociation Constant (pKa)

12.48

Base Dissociation Constant (pKb)

3.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

L120-1551 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L120-1551 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L120-1551?
Check Price and Availability of L120-1551, 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 L120-1551 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L120-1551
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L120-1551
  • 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 L120-1551 available by request