V020-1943 Screening compound: methyl 3-({[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl)-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V020-1943 Screening compound: methyl 3-({[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl)-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V020-1943 Screening compound: methyl 3-({[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl)-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1943
methyl 3-({[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl)-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-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

V020-1943

Molecular Formula

C27H27N3O7S (C27 H27 N3 O7 S)

Compound Name

methyl 3-({[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl)-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

methyl 3-({[(2H-13-benzodioxol-5-yl)methyl]carbamoyl}methyl)-5-(35-dimethoxyphenyl)-7-methyl-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C1SC=C(CC(NCc(cc2)cc3c2OCO3)=O)N1C1c2cc(OC)cc(OC)c2)=C1C(OC)=O

InChI

InChI=1S/C27H27N3O7S/c1-15-24(26(32)35-4)25(17-8-19(33-2)11-20(9-17)34-3)30-18(13-38-27(30)29-15)10-23(31)28-12-16-5-6-21-22(7-16)37-14-36-21/h5-9,11,13,25H,10,12,14H2,1-4H3,(H,28,31)/t25-/m1/s1

InChI Key

KNXNAFKCSLMZLO-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19822660

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

537.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.454

Distribution Coefficient, logD

3.453

Water Solubility, LogSw

-3.74

Polar Surface Area

89.233

Acid Dissociation Constant (pKa)

14.73

Base Dissociation Constant (pKb)

4.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with V020-1943 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1943?
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What is the minimum amount of V020-1943 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1943
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1943
  • 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 V020-1943 available by request