V018-1107 Screening compound: methyl 3-[(cyclopropylcarbamoyl)methyl]-5-(2,3-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

V018-1107 Screening compound: methyl 3-[(cyclopropylcarbamoyl)methyl]-5-(2,3-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
V018-1107 Screening compound: methyl 3-[(cyclopropylcarbamoyl)methyl]-5-(2,3-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-1107
methyl 3-[(cyclopropylcarbamoyl)methyl]-5-(2,3-dimethoxyphenyl)-7-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

V018-1107

Molecular Formula

C22H25N3O5S (C22 H25 N3 O5 S)

Compound Name

methyl 3-[(cyclopropylcarbamoyl)methyl]-5-(2,3-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

IUPAC name

methyl 3-[(cyclopropylcarbamoyl)methyl]-5-(23-dimethoxyphenyl)-7-methyl-5H-[13]thiazolo[32-a]pyrimidine-6-carboxylate

SMILES

CC(N=C1SC=C(CC(NC2CC2)=O)N1C1c(cccc2OC)c2OC)=C1C(OC)=O

InChI

InChI=1S/C22H25N3O5S/c1-12-18(21(27)30-4)19(15-6-5-7-16(28-2)20(15)29-3)25-14(11-31-22(25)23-12)10-17(26)24-13-8-9-13/h5-7,11,13,19H,8-10H2,1-4H3,(H,24,26)/t19-/m1/s1

InChI Key

VUKVHLXQSVLYBF-LJQANCHMSA-N

MDL Number (MFCD)

MFCD19832271

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.426

Distribution Coefficient, logD

2.425

Water Solubility, LogSw

-2.79

Polar Surface Area

72.434

Acid Dissociation Constant (pKa)

13.86

Base Dissociation Constant (pKb)

4.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

V018-1107 in Drug Discovery

Included in Screening Libraries

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V018-1107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-1107?
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What is the minimum amount of V018-1107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-1107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-1107
  • 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 V018-1107 available by request