V020-0476 Screening compound: methyl 3-{[(2-methoxyethyl)carbamoyl]methyl}-7-methyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V020-0476 Screening compound: methyl 3-{[(2-methoxyethyl)carbamoyl]methyl}-7-methyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V020-0476 Screening compound: methyl 3-{[(2-methoxyethyl)carbamoyl]methyl}-7-methyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-0476
methyl 3-{[(2-methoxyethyl)carbamoyl]methyl}-7-methyl-5-(4-nitrophenyl)-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

V020-0476

Molecular Formula

C20H22N4O6S (C20 H22 N4 O6 S)

Compound Name

methyl 3-{[(2-methoxyethyl)carbamoyl]methyl}-7-methyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

methyl 3-{[(2-methoxyethyl)carbamoyl]methyl}-7-methyl-5-(4-nitrophenyl)-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C1SC=C(CC(NCCOC)=O)N1C1c(cc2)ccc2[N+]([O-])=O)=C1C(OC)=O

InChI

InChI=1S/C20H22N4O6S/c1-12-17(19(26)30-3)18(13-4-6-14(7-5-13)24(27)28)23-15(11-31-20(23)22-12)10-16(25)21-8-9-29-2/h4-7,11,18H,8-10H2,1-3H3,(H,21,25)/t18-/m1/s1

InChI Key

AGDAVEJWAWMZNT-GOSISDBHSA-N

MDL Number (MFCD)

MFCD19822869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.48

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

1.856

Distribution Coefficient, logD

1.855

Water Solubility, LogSw

-2.39

Polar Surface Area

98.867

Acid Dissociation Constant (pKa)

14.67

Base Dissociation Constant (pKb)

4.55

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with V020-0476 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-0476?
Check Price and Availability of V020-0476, 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 V020-0476 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-0476
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-0476
  • 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 V020-0476 available by request