V002-1476 Screening compound: ethyl 4-(2-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)tetrahydro-1(2H)-pyrazinecarboxylate

V002-1476 Screening compound: ethyl 4-(2-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)tetrahydro-1(2H)-pyrazinecarboxylate
V002-1476 Screening compound: ethyl 4-(2-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)tetrahydro-1(2H)-pyrazinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-1476
ethyl 4-(2-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)tetrahydro-1(2H)-pyrazinecarboxylate

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

V002-1476

Molecular Formula

C21H30N4O2S (C21 H30 N4 O2 S)

Compound Name

ethyl 4-(2-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)tetrahydro-1(2H)-pyrazinecarboxylate

IUPAC name

ethyl 4-{5-butyl-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraen-3-yl}piperazine-1-carboxylate

SMILES

CCCCc1nc(N(CC2)CCN2C(OCC)=O)c(c(CCCC2)c2s2)c2n1

InChI

InChI=1S/C21H30N4O2S/c1-3-5-10-17-22-19(24-11-13-25(14-12-24)21(26)27-4-2)18-15-8-6-7-9-16(15)28-20(18)23-17/h3-14H2,1-2H3

InChI Key

OAWNHCGZRJUSKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19852578

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.704

Distribution Coefficient, logD

5.092

Water Solubility, LogSw

-5.35

Polar Surface Area

46.991

Acid Dissociation Constant (pKa)

22.62

Base Dissociation Constant (pKb)

7.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

References: we are preparing a list of scientific research reports with V002-1476 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-1476?
Check Price and Availability of V002-1476, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V002-1476 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-1476
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-1476
  • 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 V002-1476 available by request