V020-3661 Screening compound: N-{4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl}-3-(trifluoromethyl)benzamide

V020-3661 Screening compound: N-{4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl}-3-(trifluoromethyl)benzamide
V020-3661 Screening compound: N-{4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl}-3-(trifluoromethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-3661
N-{4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl}-3-(trifluoromethyl)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

V020-3661

Molecular Formula

C26H24F3N3O2 (C26 H24 F3 N3 O2)

Compound Name

N-{4-[2-oxo-3-(1-phenylethyl)-1,3-diazinan-1-yl]phenyl}-3-(trifluoromethyl)benzamide

IUPAC name

N-{4-[2-oxo-3-(1-phenylethyl)-13-diazinan-1-yl]phenyl}-3-(trifluoromethyl)benzamide

SMILES

CC(c1ccccc1)N(CCCN1c(cc2)ccc2NC(c2cccc(C(F)(F)F)c2)=O)C1=O

InChI

InChI=1S/C26H24F3N3O2/c1-18(19-7-3-2-4-8-19)31-15-6-16-32(25(31)34)23-13-11-22(12-14-23)30-24(33)20-9-5-10-21(17-20)26(27,28)29/h2-5,7-14,17-18H,6,15-16H2,1H3,(H,30,33)/t18-/m0/s1

InChI Key

HTSJNISXQAPYQO-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19929560

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.637

Distribution Coefficient, logD

5.637

Water Solubility, LogSw

-5.47

Polar Surface Area

42.395

Acid Dissociation Constant (pKa)

10.46

Base Dissociation Constant (pKb)

0.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with V020-3661 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-3661?
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What is the minimum amount of V020-3661 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-3661
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-3661
  • 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 V020-3661 available by request