V030-4244 Screening compound: N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitro-N-(1-phenylethyl)benzamide

V030-4244 Screening compound: N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitro-N-(1-phenylethyl)benzamide
V030-4244 Screening compound: N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitro-N-(1-phenylethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-4244
N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitro-N-(1-phenylethyl)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

V030-4244

Molecular Formula

C27H26N4O6 (C27 H26 N4 O6)

Compound Name

N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitro-N-(1-phenylethyl)benzamide

IUPAC name

N-{2-[3-(34-dimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}-3-nitro-N-(1-phenylethyl)benzamide

SMILES

CC(c1ccccc1)N(CCc1nc(-c(cc2)cc(OC)c2OC)no1)C(c1cccc([N+]([O-])=O)c1)=O

InChI

InChI=1S/C27H26N4O6/c1-18(19-8-5-4-6-9-19)30(27(32)21-10-7-11-22(16-21)31(33)34)15-14-25-28-26(29-37-25)20-12-13-23(35-2)24(17-20)36-3/h4-13,16-18H,14-15H2,1-3H3/t18-/m0/s1

InChI Key

LYMVMFMKPFPITD-SFHVURJKSA-N

MDL Number (MFCD)

MFCD20493711

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

502.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.330

Distribution Coefficient, logD

5.330

Water Solubility, LogSw

-5.47

Polar Surface Area

95.506

Acid Dissociation Constant (pKa)

25.02

Base Dissociation Constant (pKb)

-4.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with V030-4244 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-4244?
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What is the minimum amount of V030-4244 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-4244
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-4244
  • 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 V030-4244 available by request