V019-3431 Screening compound: tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-({[(pyridin-3-yl)methyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V019-3431 Screening compound: tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-({[(pyridin-3-yl)methyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V019-3431 Screening compound: tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-({[(pyridin-3-yl)methyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-3431
tert-butyl 5-(2,3-dimethoxyphenyl)-7-methyl-3-({[(pyridin-3-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

V019-3431

Molecular Formula

C28H32N4O5S (C28 H32 N4 O5 S)

Compound Name

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

IUPAC name

tert-butyl 5-(23-dimethoxyphenyl)-7-methyl-3-({[(pyridin-3-yl)methyl]carbamoyl}methyl)-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(C)(C)OC(C1=C(C)N=C2SC=C(CC(NCc3cnccc3)=O)N2C1c(cccc1OC)c1OC)=O

InChI

InChI=1S/C28H32N4O5S/c1-17-23(26(34)37-28(2,3)4)24(20-10-7-11-21(35-5)25(20)36-6)32-19(16-38-27(32)31-17)13-22(33)30-15-18-9-8-12-29-14-18/h7-12,14,16,24H,13,15H2,1-6H3,(H,30,33)/t24-/m1/s1

InChI Key

YVCKVJYRQSFJCQ-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19829808

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

536.65

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.493

Distribution Coefficient, logD

3.489

Water Solubility, LogSw

-3.53

Polar Surface Area

80.585

Acid Dissociation Constant (pKa)

14.02

Base Dissociation Constant (pKb)

5.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

V019-3431 in Drug Discovery

Included in Screening Libraries

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V019-3431 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-3431?
Check Price and Availability of V019-3431, 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 V019-3431 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-3431
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-3431
  • 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 V019-3431 available by request