V011-7231 Screening compound: 2,6-difluoro-N-(4-methoxy-3-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide

V011-7231 Screening compound: 2,6-difluoro-N-(4-methoxy-3-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide
V011-7231 Screening compound: 2,6-difluoro-N-(4-methoxy-3-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-7231
2,6-difluoro-N-(4-methoxy-3-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide

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

V011-7231

Molecular Formula

C26H25F2N3O4 (C26 H25 F2 N3 O4)

Compound Name

2,6-difluoro-N-(4-methoxy-3-{3-[(4-methoxyphenyl)methyl]-2-oxo-1,3-diazinan-1-yl}phenyl)benzamide

IUPAC name

26-difluoro-N-(4-methoxy-3-{3-[(4-methoxyphenyl)methyl]-2-oxo-13-diazinan-1-yl}phenyl)benzamide

SMILES

COc1ccc(CN(CCCN2c(cc(cc3)NC(c(c(F)ccc4)c4F)=O)c3OC)C2=O)cc1

InChI

InChI=1S/C26H25F2N3O4/c1-34-19-10-7-17(8-11-19)16-30-13-4-14-31(26(30)33)22-15-18(9-12-23(22)35-2)29-25(32)24-20(27)5-3-6-21(24)28/h3,5-12,15H,4,13-14,16H2,1-2H3,(H,29,32)

InChI Key

NNHJJUUCIJUUPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19931798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.518

Distribution Coefficient, logD

4.445

Water Solubility, LogSw

-4.48

Polar Surface Area

57.761

Acid Dissociation Constant (pKa)

8.14

Base Dissociation Constant (pKb)

-0.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with V011-7231 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-7231?
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What is the minimum amount of V011-7231 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-7231
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-7231
  • 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 V011-7231 available by request