V022-6350 Screening compound: ethyl 6-[(3,4-dimethylphenoxy)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V022-6350 Screening compound: ethyl 6-[(3,4-dimethylphenoxy)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V022-6350 Screening compound: ethyl 6-[(3,4-dimethylphenoxy)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6350
ethyl 6-[(3,4-dimethylphenoxy)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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

V022-6350

Molecular Formula

C29H30N2O5 (C29 H30 N2 O5)

Compound Name

ethyl 6-[(3,4-dimethylphenoxy)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

IUPAC name

ethyl 6-[(34-dimethylphenoxy)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c1cc(Oc2ccccc2)ccc1)N1)=C(COc2cc(C)c(C)cc2)N(C)C1=O)=O

InChI

InChI=1S/C29H30N2O5/c1-5-34-28(32)26-25(18-35-23-15-14-19(2)20(3)16-23)31(4)29(33)30-27(26)21-10-9-13-24(17-21)36-22-11-7-6-8-12-22/h6-17,27H,5,18H2,1-4H3,(H,30,33)/t27-/m1/s1

InChI Key

WKKWGXJVLQAUQP-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19834388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.114

Distribution Coefficient, logD

6.112

Water Solubility, LogSw

-5.51

Polar Surface Area

62.765

Acid Dissociation Constant (pKa)

9.80

Base Dissociation Constant (pKb)

-4.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.10

V022-6350 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with V022-6350 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6350?
Check Price and Availability of V022-6350, 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 V022-6350 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6350
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6350
  • 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 V022-6350 available by request