V003-3390 Screening compound: ethyl 1-(2-{5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-6-[(propan-2-yloxy)carbonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperidine-3-carboxylate

V003-3390 Screening compound: ethyl 1-(2-{5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-6-[(propan-2-yloxy)carbonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperidine-3-carboxylate
V003-3390 Screening compound: ethyl 1-(2-{5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-6-[(propan-2-yloxy)carbonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-3390
ethyl 1-(2-{5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-6-[(propan-2-yloxy)carbonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperidine-3-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

V003-3390

Molecular Formula

C35H41N3O7S (C35 H41 N3 O7 S)

Compound Name

ethyl 1-(2-{5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-6-[(propan-2-yloxy)carbonyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetyl)piperidine-3-carboxylate

IUPAC name

ethyl 1-(2-{5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-6-[(propan-2-yloxy)carbonyl]-5H-[13]thiazolo[32-a]pyrimidin-3-yl}acetyl)piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1C(CC(N1C2c(cc3)cc(OC)c3OCc3ccccc3)=CSC1=NC(C)=C2C(OC(C)C)=O)=O)=O

InChI

InChI=1S/C35H41N3O7S/c1-6-43-33(40)26-13-10-16-37(19-26)30(39)18-27-21-46-35-36-23(4)31(34(41)45-22(2)3)32(38(27)35)25-14-15-28(29(17-25)42-5)44-20-24-11-8-7-9-12-24/h7-9,11-12,14-15,17,21-22,26,32H,6,10,13,16,18-20H2,1-5H3

InChI Key

IATTZNXRUDYPEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19978506

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

647.79

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.329

Distribution Coefficient, logD

5.327

Water Solubility, LogSw

-5.29

Polar Surface Area

83.842

Acid Dissociation Constant (pKa)

19.95

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with V003-3390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-3390?
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What is the minimum amount of V003-3390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-3390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-3390
  • 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 V003-3390 available by request