V027-0804 Screening compound: N-[(2-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-fluorobenzamide

V027-0804 Screening compound: N-[(2-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-fluorobenzamide
V027-0804 Screening compound: N-[(2-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-0804
N-[(2-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-fluorobenzamide

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

V027-0804

Molecular Formula

C24H18Cl3FN2O2 (C24 H18 Cl3 FN2 O2)

Compound Name

N-[(2-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-3-fluorobenzamide

IUPAC name

N-[(2-chlorophenyl)methyl]-N-{[3-(34-dichlorophenyl)-45-dihydro-12-oxazol-5-yl]methyl}-3-fluorobenzamide

SMILES

O=C(c1cc(F)ccc1)N(CC(C1)ON=C1c(cc1)cc(Cl)c1Cl)Cc(cccc1)c1Cl

InChI

InChI=1S/C24H18Cl3FN2O2/c25-20-7-2-1-4-17(20)13-30(24(31)16-5-3-6-18(28)10-16)14-19-12-23(29-32-19)15-8-9-21(26)22(27)11-15/h1-11,19H,12-14H2/t19-/m0/s1

InChI Key

FAQQQWZMAPAYNK-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19802392

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

491.78

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.538

Distribution Coefficient, logD

6.538

Water Solubility, LogSw

-6.47

Polar Surface Area

39.014

Acid Dissociation Constant (pKa)

22.13

Base Dissociation Constant (pKb)

-5.99

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with V027-0804 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-0804?
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What is the minimum amount of V027-0804 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-0804
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-0804
  • 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 V027-0804 available by request