V007-1813 Screening compound: 2-{4-[4-(difluoromethoxy)benzoyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide

V007-1813 Screening compound: 2-{4-[4-(difluoromethoxy)benzoyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide
V007-1813 Screening compound: 2-{4-[4-(difluoromethoxy)benzoyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-1813
2-{4-[4-(difluoromethoxy)benzoyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-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

V007-1813

Molecular Formula

C28H30F2N4O5 (C28 H30 F2 N4 O5)

Compound Name

2-{4-[4-(difluoromethoxy)benzoyl]piperazin-1-yl}-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide

IUPAC name

2-{4-[4-(difluoromethoxy)benzoyl]piperazin-1-yl}-N-[2-(34-dimethoxyphenyl)ethyl]pyridine-3-carboxamide

SMILES

COc(ccc(CCNC(c1cccnc1N(CC1)CCN1C(c(cc1)ccc1OC(F)F)=O)=O)c1)c1OC

InChI

InChI=1S/C28H30F2N4O5/c1-37-23-10-5-19(18-24(23)38-2)11-13-32-26(35)22-4-3-12-31-25(22)33-14-16-34(17-15-33)27(36)20-6-8-21(9-7-20)39-28(29)30/h3-10,12,18,28H,11,13-17H2,1-2H3,(H,32,35)

InChI Key

PXVHVCFUDQWKOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19946196

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

540.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.715

Distribution Coefficient, logD

2.715

Water Solubility, LogSw

-3.23

Polar Surface Area

75.249

Acid Dissociation Constant (pKa)

12.44

Base Dissociation Constant (pKb)

4.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

References: we are preparing a list of scientific research reports with V007-1813 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-1813?
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What is the minimum amount of V007-1813 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-1813
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-1813
  • 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 V007-1813 available by request