V020-7278 Screening compound: ethyl 1-[2-(sec-butyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]-3-piperidinecarboxylate

V020-7278 Screening compound: ethyl 1-[2-(sec-butyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]-3-piperidinecarboxylate
V020-7278 Screening compound: ethyl 1-[2-(sec-butyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]-3-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-7278
ethyl 1-[2-(sec-butyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl]-3-piperidinecarboxylate

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

V020-7278

Molecular Formula

C22H31N3O2S (C22 H31 N3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CCC(C)c1nc(N(CCC2)CC2C(OCC)=O)c(c(CCCC2)c2s2)c2n1

InChI

InChI=1S/C22H31N3O2S/c1-4-14(3)19-23-20(25-12-8-9-15(13-25)22(26)27-5-2)18-16-10-6-7-11-17(16)28-21(18)24-19/h14-15H,4-13H2,1-3H3

InChI Key

YJFQBERDDJWYJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19852568

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

401.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.871

Distribution Coefficient, logD

5.410

Water Solubility, LogSw

-5.45

Polar Surface Area

43.907

Acid Dissociation Constant (pKa)

21.74

Base Dissociation Constant (pKb)

7.68

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

68.20

References: we are preparing a list of scientific research reports with V020-7278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-7278?
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What is the minimum amount of V020-7278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-7278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-7278
  • 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 V020-7278 available by request