V020-1413 Screening compound: 3-{[benzyl(methyl)carbamoyl]methyl}-N-(4-methoxyphenyl)-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

V020-1413 Screening compound: 3-{[benzyl(methyl)carbamoyl]methyl}-N-(4-methoxyphenyl)-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
V020-1413 Screening compound: 3-{[benzyl(methyl)carbamoyl]methyl}-N-(4-methoxyphenyl)-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-1413
3-{[benzyl(methyl)carbamoyl]methyl}-N-(4-methoxyphenyl)-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

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

V020-1413

Molecular Formula

C34H36N4O3S (C34 H36 N4 O3 S)

Compound Name

3-{[benzyl(methyl)carbamoyl]methyl}-N-(4-methoxyphenyl)-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

IUPAC name

3-{[benzyl(methyl)carbamoyl]methyl}-N-(4-methoxyphenyl)-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[13]thiazolo[32-a]pyrimidine-6-carboxamide

SMILES

CC(C)c1ccc(C2N(C(CC(N(C)Cc3ccccc3)=O)=CS3)C3=NC(C)=C2C(Nc(cc2)ccc2OC)=O)cc1

InChI

InChI=1S/C34H36N4O3S/c1-22(2)25-11-13-26(14-12-25)32-31(33(40)36-27-15-17-29(41-5)18-16-27)23(3)35-34-38(32)28(21-42-34)19-30(39)37(4)20-24-9-7-6-8-10-24/h6-18,21-22,32H,19-20H2,1-5H3,(H,36,40)/t32-/m1/s1

InChI Key

FJNTZLIKRVSAGI-JGCGQSQUSA-N

MDL Number (MFCD)

MFCD19838833

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

580.75

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.623

Distribution Coefficient, logD

6.622

Water Solubility, LogSw

-5.72

Polar Surface Area

57.915

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

3.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.50

References: we are preparing a list of scientific research reports with V020-1413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-1413?
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What is the minimum amount of V020-1413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-1413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-1413
  • 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 V020-1413 available by request