L277-0089 Screening compound: N-(2,4-difluorophenyl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]methyl}piperazine-1-carboxamide

L277-0089 Screening compound: N-(2,4-difluorophenyl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]methyl}piperazine-1-carboxamide
L277-0089 Screening compound: N-(2,4-difluorophenyl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]methyl}piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L277-0089
N-(2,4-difluorophenyl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]methyl}piperazine-1-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

L277-0089

Molecular Formula

C25H28F2N6O2 (C25 H28 F2 N6 O2)

Compound Name

N-(2,4-difluorophenyl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-1,3-benzodiazol-2-yl]methyl}piperazine-1-carboxamide

IUPAC name

N-(24-difluorophenyl)-4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-13-benzodiazol-2-yl]methyl}piperazine-1-carboxamide

SMILES

Cn1c(ccc(C(N2CCCC2)=O)c2)c2nc1CN(CC1)CCN1C(Nc(ccc(F)c1)c1F)=O

InChI

InChI=1S/C25H28F2N6O2/c1-30-22-7-4-17(24(34)32-8-2-3-9-32)14-21(22)28-23(30)16-31-10-12-33(13-11-31)25(35)29-20-6-5-18(26)15-19(20)27/h4-7,14-15H,2-3,8-13,16H2,1H3,(H,29,35)

InChI Key

GWAAIGKCDQDGDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27239143

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.376

Distribution Coefficient, logD

1.931

Water Solubility, LogSw

-3.04

Polar Surface Area

57.551

Acid Dissociation Constant (pKa)

10.34

Base Dissociation Constant (pKb)

7.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

L277-0089 in Drug Discovery

Included in Screening Libraries

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

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L277-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L277-0089?
Check Price and Availability of L277-0089, 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 L277-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L277-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L277-0089
  • 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 L277-0089 available by request