V019-9453 Screening compound: 3-[(benzylcarbamoyl)methyl]-5-(2-chlorophenyl)-N,N-diethyl-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

V019-9453 Screening compound: 3-[(benzylcarbamoyl)methyl]-5-(2-chlorophenyl)-N,N-diethyl-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
V019-9453 Screening compound: 3-[(benzylcarbamoyl)methyl]-5-(2-chlorophenyl)-N,N-diethyl-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V019-9453
3-[(benzylcarbamoyl)methyl]-5-(2-chlorophenyl)-N,N-diethyl-7-methyl-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

V019-9453

Molecular Formula

C27H29ClN4O2S (C27 H29 ClN4 O2 S)

Compound Name

3-[(benzylcarbamoyl)methyl]-5-(2-chlorophenyl)-N,N-diethyl-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

IUPAC name

3-[(benzylcarbamoyl)methyl]-5-(2-chlorophenyl)-NN-diethyl-7-methyl-5H-[13]thiazolo[32-a]pyrimidine-6-carboxamide

SMILES

CCN(CC)C(C1=C(C)N=C2SC=C(CC(NCc3ccccc3)=O)N2C1c(cccc1)c1Cl)=O

InChI

InChI=1S/C27H29ClN4O2S/c1-4-31(5-2)26(34)24-18(3)30-27-32(25(24)21-13-9-10-14-22(21)28)20(17-35-27)15-23(33)29-16-19-11-7-6-8-12-19/h6-14,17,25H,4-5,15-16H2,1-3H3,(H,29,33)/t25-/m0/s1

InChI Key

AWGORJAVPLYMQR-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19822750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

509.07

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.281

Distribution Coefficient, logD

4.281

Water Solubility, LogSw

-4.39

Polar Surface Area

51.789

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

2.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with V019-9453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V019-9453?
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What is the minimum amount of V019-9453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V019-9453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V019-9453
  • 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 V019-9453 available by request