V019-6142 Screening compound: N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-2-phenylbutanamide

V019-6142 Screening compound: N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-2-phenylbutanamide
V019-6142 Screening compound: N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-2-phenylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-6142
N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-2-phenylbutanamide

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

V019-6142

Molecular Formula

C29H30F3N3O3 (C29 H30 F3 N3 O3)

Compound Name

N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethoxy)phenyl]methyl}-1,3-diazinan-1-yl)phenyl]-2-phenylbutanamide

IUPAC name

N-[5-methyl-2-(2-oxo-3-{[4-(trifluoromethoxy)phenyl]methyl}-13-diazinan-1-yl)phenyl]-2-phenylbutanamide

SMILES

CCC(C(Nc(cc(C)cc1)c1N(CCCN1Cc(cc2)ccc2OC(F)(F)F)C1=O)=O)c1ccccc1

InChI

InChI=1S/C29H30F3N3O3/c1-3-24(22-8-5-4-6-9-22)27(36)33-25-18-20(2)10-15-26(25)35-17-7-16-34(28(35)37)19-21-11-13-23(14-12-21)38-29(30,31)32/h4-6,8-15,18,24H,3,7,16-17,19H2,1-2H3,(H,33,36)/t24-/m1/s1

InChI Key

LESBTJUQFGQUAJ-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19930515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

525.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.798

Distribution Coefficient, logD

6.797

Water Solubility, LogSw

-5.63

Polar Surface Area

47.826

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.00

References: we are preparing a list of scientific research reports with V019-6142 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-6142?
Check Price and Availability of V019-6142, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V019-6142 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-6142
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-6142
  • 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 V019-6142 available by request