V008-0890 Screening compound: ethyl 4-(2-chlorophenyl)-6-[(2-methoxyphenoxy)methyl]-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V008-0890 Screening compound: ethyl 4-(2-chlorophenyl)-6-[(2-methoxyphenoxy)methyl]-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V008-0890 Screening compound: ethyl 4-(2-chlorophenyl)-6-[(2-methoxyphenoxy)methyl]-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-0890
ethyl 4-(2-chlorophenyl)-6-[(2-methoxyphenoxy)methyl]-1-methyl-2-oxo-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

V008-0890

Molecular Formula

C22H23ClN2O5 (C22 H23 ClN2 O5)

Compound Name

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

IUPAC name

ethyl 4-(2-chlorophenyl)-6-[(2-methoxyphenoxy)methyl]-1-methyl-2-oxo-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c(cccc1)c1Cl)N1)=C(COc(cccc2)c2OC)N(C)C1=O)=O

InChI

InChI=1S/C22H23ClN2O5/c1-4-29-21(26)19-16(13-30-18-12-8-7-11-17(18)28-3)25(2)22(27)24-20(19)14-9-5-6-10-15(14)23/h5-12,20H,4,13H2,1-3H3,(H,24,27)/t20-/m0/s1

InChI Key

RNHQLRAYZOXVCR-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19831787

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.89

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

3.759

Distribution Coefficient, logD

3.754

Water Solubility, LogSw

-4.00

Polar Surface Area

63.735

Acid Dissociation Constant (pKa)

9.30

Base Dissociation Constant (pKb)

-5.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with V008-0890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-0890?
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What is the minimum amount of V008-0890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-0890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-0890
  • 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 V008-0890 available by request