V020-1912 Screening compound: ethyl 7-methyl-5-(3-nitrophenyl)-3-({[(oxolan-2-yl)methyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V020-1912 Screening compound: ethyl 7-methyl-5-(3-nitrophenyl)-3-({[(oxolan-2-yl)methyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V020-1912 Screening compound: ethyl 7-methyl-5-(3-nitrophenyl)-3-({[(oxolan-2-yl)methyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1912
ethyl 7-methyl-5-(3-nitrophenyl)-3-({[(oxolan-2-yl)methyl]carbamoyl}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

V020-1912

Molecular Formula

C23H26N4O6S (C23 H26 N4 O6 S)

Compound Name

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

IUPAC name

ethyl 7-methyl-5-(3-nitrophenyl)-3-({[(oxolan-2-yl)methyl]carbamoyl}methyl)-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CCOC(C1=C(C)N=C2SC=C(CC(NCC3OCCC3)=O)N2C1c1cc([N+]([O-])=O)ccc1)=O

InChI

InChI=1S/C23H26N4O6S/c1-3-32-22(29)20-14(2)25-23-26(21(20)15-6-4-7-16(10-15)27(30)31)17(13-34-23)11-19(28)24-12-18-8-5-9-33-18/h4,6-7,10,13,18,21H,3,5,8-9,11-12H2,1-2H3,(H,24,28)

InChI Key

RAGJCPPXPLCLIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19823289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.364

Distribution Coefficient, logD

2.363

Water Solubility, LogSw

-2.73

Polar Surface Area

98.646

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V020-1912 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1912?
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What is the minimum amount of V020-1912 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1912
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1912
  • 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 V020-1912 available by request