V010-4610 Screening compound: methyl 5-(2,4-dimethylphenyl)-7-methyl-3-{[(1-phenylethyl)carbamoyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V010-4610 Screening compound: methyl 5-(2,4-dimethylphenyl)-7-methyl-3-{[(1-phenylethyl)carbamoyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V010-4610 Screening compound: methyl 5-(2,4-dimethylphenyl)-7-methyl-3-{[(1-phenylethyl)carbamoyl]methyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-4610
methyl 5-(2,4-dimethylphenyl)-7-methyl-3-{[(1-phenylethyl)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

V010-4610

Molecular Formula

C27H29N3O3S (C27 H29 N3 O3 S)

Compound Name

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

IUPAC name

methyl 5-(24-dimethylphenyl)-7-methyl-3-{[(1-phenylethyl)carbamoyl]methyl}-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(c1ccccc1)NC(CC(N1C2c3c(C)cc(C)cc3)=CSC1=NC(C)=C2C(OC)=O)=O

InChI

InChI=1S/C27H29N3O3S/c1-16-11-12-22(17(2)13-16)25-24(26(32)33-5)19(4)29-27-30(25)21(15-34-27)14-23(31)28-18(3)20-9-7-6-8-10-20/h6-13,15,18,25H,14H2,1-5H3,(H,28,31)

InChI Key

QCFLXDHGPBNSGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19826775

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.980

Distribution Coefficient, logD

4.977

Water Solubility, LogSw

-4.63

Polar Surface Area

56.193

Acid Dissociation Constant (pKa)

13.20

Base Dissociation Constant (pKb)

5.21

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with V010-4610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-4610?
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What is the minimum amount of V010-4610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-4610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-4610
  • 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 V010-4610 available by request