V029-4254 Screening compound: 2-{1-[5-(2,4-dichlorophenyl)-1,2-oxazol-3-yl]-N-methylformamido}-N-[(oxolan-2-yl)methyl]acetamide

V029-4254 Screening compound: 2-{1-[5-(2,4-dichlorophenyl)-1,2-oxazol-3-yl]-N-methylformamido}-N-[(oxolan-2-yl)methyl]acetamide
V029-4254 Screening compound: 2-{1-[5-(2,4-dichlorophenyl)-1,2-oxazol-3-yl]-N-methylformamido}-N-[(oxolan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-4254
2-{1-[5-(2,4-dichlorophenyl)-1,2-oxazol-3-yl]-N-methylformamido}-N-[(oxolan-2-yl)methyl]acetamide

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

V029-4254

Molecular Formula

C18H19Cl2N3O4 (C18 H19 Cl2 N3 O4)

Compound Name

2-{1-[5-(2,4-dichlorophenyl)-1,2-oxazol-3-yl]-N-methylformamido}-N-[(oxolan-2-yl)methyl]acetamide

IUPAC name

2-{1-[5-(24-dichlorophenyl)-12-oxazol-3-yl]-N-methylformamido}-N-[(oxolan-2-yl)methyl]acetamide

SMILES

CN(CC(NCC1OCCC1)=O)C(c1noc(-c(ccc(Cl)c2)c2Cl)c1)=O

InChI

InChI=1S/C18H19Cl2N3O4/c1-23(10-17(24)21-9-12-3-2-6-26-12)18(25)15-8-16(27-22-15)13-5-4-11(19)7-14(13)20/h4-5,7-8,12H,2-3,6,9-10H2,1H3,(H,21,24)/t12-/m1/s1

InChI Key

NVOWMUUVVBWVPU-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD19813165

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

412.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.353

Distribution Coefficient, logD

2.353

Water Solubility, LogSw

-3.61

Polar Surface Area

71.050

Acid Dissociation Constant (pKa)

14.43

Base Dissociation Constant (pKb)

2.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.90

V029-4254 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V029-4254 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-4254?
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What is the minimum amount of V029-4254 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-4254
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-4254
  • 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 V029-4254 available by request