V011-0180 Screening compound: ethyl 6-[(4-methoxyphenoxy)methyl]-1-methyl-2-oxo-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

V011-0180 Screening compound: ethyl 6-[(4-methoxyphenoxy)methyl]-1-methyl-2-oxo-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
V011-0180 Screening compound: ethyl 6-[(4-methoxyphenoxy)methyl]-1-methyl-2-oxo-4-(thiophen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-0180
ethyl 6-[(4-methoxyphenoxy)methyl]-1-methyl-2-oxo-4-(thiophen-3-yl)-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

V011-0180

Molecular Formula

C20H22N2O5S (C20 H22 N2 O5 S)

Compound Name

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

IUPAC name

ethyl 6-[(4-methoxyphenoxy)methyl]-1-methyl-2-oxo-4-(thiophen-3-yl)-1234-tetrahydropyrimidine-5-carboxylate

SMILES

CCOC(C(C(c1cscc1)N1)=C(COc(cc2)ccc2OC)N(C)C1=O)=O

InChI

InChI=1S/C20H22N2O5S/c1-4-26-19(23)17-16(11-27-15-7-5-14(25-3)6-8-15)22(2)20(24)21-18(17)13-9-10-28-12-13/h5-10,12,18H,4,11H2,1-3H3,(H,21,24)/t18-/m0/s1

InChI Key

VWFSVGGJBFAQRZ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14480269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.47

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

3.129

Distribution Coefficient, logD

3.129

Water Solubility, LogSw

-3.31

Polar Surface Area

64.580

Acid Dissociation Constant (pKa)

10.51

Base Dissociation Constant (pKb)

-4.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with V011-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-0180?
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What is the minimum amount of V011-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-0180
  • 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 V011-0180 available by request