V011-9750 Screening compound: 2-methoxyethyl 3-{[(3,5-dimethylphenyl)carbamoyl]methyl}-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V011-9750 Screening compound: 2-methoxyethyl 3-{[(3,5-dimethylphenyl)carbamoyl]methyl}-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V011-9750 Screening compound: 2-methoxyethyl 3-{[(3,5-dimethylphenyl)carbamoyl]methyl}-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-9750
2-methoxyethyl 3-{[(3,5-dimethylphenyl)carbamoyl]methyl}-7-methyl-5-phenyl-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

V011-9750

Molecular Formula

C27H29N3O4S (C27 H29 N3 O4 S)

Compound Name

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

IUPAC name

2-methoxyethyl 3-{[(35-dimethylphenyl)carbamoyl]methyl}-7-methyl-5-phenyl-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

Cc1cc(NC(CC(N2C3c4ccccc4)=CSC2=NC(C)=C3C(OCCOC)=O)=O)cc(C)c1

InChI

InChI=1S/C27H29N3O4S/c1-17-12-18(2)14-21(13-17)29-23(31)15-22-16-35-27-28-19(3)24(26(32)34-11-10-33-4)25(30(22)27)20-8-6-5-7-9-20/h5-9,12-14,16,25H,10-11,15H2,1-4H3,(H,29,31)/t25-/m1/s1

InChI Key

PNPQFTFSGGPSCD-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19974140

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.147

Distribution Coefficient, logD

4.146

Water Solubility, LogSw

-4.28

Polar Surface Area

63.925

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with V011-9750 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-9750?
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What is the minimum amount of V011-9750 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-9750
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-9750
  • 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 V011-9750 available by request