V025-2228 Screening compound: prop-2-en-1-yl 5-(4-chlorophenyl)-7-methyl-3-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V025-2228 Screening compound: prop-2-en-1-yl 5-(4-chlorophenyl)-7-methyl-3-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V025-2228 Screening compound: prop-2-en-1-yl 5-(4-chlorophenyl)-7-methyl-3-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-2228
prop-2-en-1-yl 5-(4-chlorophenyl)-7-methyl-3-({[2-(pyrrolidin-1-yl)ethyl]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

V025-2228

Molecular Formula

C25H29ClN4O3S (C25 H29 ClN4 O3 S)

Compound Name

prop-2-en-1-yl 5-(4-chlorophenyl)-7-methyl-3-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

prop-2-en-1-yl 5-(4-chlorophenyl)-7-methyl-3-({[2-(pyrrolidin-1-yl)ethyl]carbamoyl}methyl)-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C1SC=C(CC(NCCN2CCCC2)=O)N1C1c(cc2)ccc2Cl)=C1C(OCC=C)=O

InChI

InChI=1S/C25H29ClN4O3S/c1-3-14-33-24(32)22-17(2)28-25-30(23(22)18-6-8-19(26)9-7-18)20(16-34-25)15-21(31)27-10-13-29-11-4-5-12-29/h3,6-9,16,23H,1,4-5,10-15H2,2H3,(H,27,31)/t23-/m0/s1

InChI Key

YDGZFCVBVVXLFT-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19822607

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

501.05

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.292

Distribution Coefficient, logD

1.067

Water Solubility, LogSw

-3.95

Polar Surface Area

61.094

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

9.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with V025-2228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-2228?
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What is the minimum amount of V025-2228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-2228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-2228
  • 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 V025-2228 available by request