D305-0061 Screening compound: N-{1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-carboxamide

D305-0061 Screening compound: N-{1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-carboxamide
D305-0061 Screening compound: N-{1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-0061
N-{1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-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

D305-0061

Molecular Formula

C20H25N5O2 (C20 H25 N5 O2)

Compound Name

N-{1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-carboxamide

IUPAC name

N-{1-ethyl-2-[(4-methylpiperazin-1-yl)methyl]-1H-13-benzodiazol-5-yl}furan-2-carboxamide

SMILES

CCn1c(ccc(NC(c2ccco2)=O)c2)c2nc1CN1CCN(C)CC1

InChI

InChI=1S/C20H25N5O2/c1-3-25-17-7-6-15(21-20(26)18-5-4-12-27-18)13-16(17)22-19(25)14-24-10-8-23(2)9-11-24/h4-7,12-13H,3,8-11,14H2,1-2H3,(H,21,26)

InChI Key

ISKMANURKCZQEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09767093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.023

Distribution Coefficient, logD

1.052

Water Solubility, LogSw

-2.78

Polar Surface Area

50.018

Acid Dissociation Constant (pKa)

11.43

Base Dissociation Constant (pKb)

8.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with D305-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-0061?
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What is the minimum amount of D305-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-0061
  • 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 D305-0061 available by request