V025-0872 Screening compound: N-{4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}furan-2-carboxamide

V025-0872 Screening compound: N-{4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}furan-2-carboxamide
V025-0872 Screening compound: N-{4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-0872
N-{4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}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

V025-0872

Molecular Formula

C28H30N4O6 (C28 H30 N4 O6)

Compound Name

N-{4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}furan-2-carboxamide

IUPAC name

N-{4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-(morpholine-4-carbonyl)phenyl}furan-2-carboxamide

SMILES

COc(cc1)ccc1C(N(CC1)CCN1c(ccc(NC(c1ccco1)=O)c1)c1C(N1CCOCC1)=O)=O

InChI

InChI=1S/C28H30N4O6/c1-36-22-7-4-20(5-8-22)27(34)31-12-10-30(11-13-31)24-9-6-21(29-26(33)25-3-2-16-38-25)19-23(24)28(35)32-14-17-37-18-15-32/h2-9,16,19H,10-15,17-18H2,1H3,(H,29,33)

InChI Key

WOPQPBNHPJMDDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14258789

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

518.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.267

Distribution Coefficient, logD

2.267

Water Solubility, LogSw

-3.13

Polar Surface Area

83.616

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

1.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

V025-0872 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V025-0872 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-0872?
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What is the minimum amount of V025-0872 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-0872
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-0872
  • 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 V025-0872 available by request