V017-5977 Screening compound: 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-3,3-dimethyl-1-butanone

V017-5977 Screening compound: 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-3,3-dimethyl-1-butanone
V017-5977 Screening compound: 1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-3,3-dimethyl-1-butanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-5977
1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-3,3-dimethyl-1-butanone

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

V017-5977

Molecular Formula

C24H34N4OS (C24 H34 N4 OS)

Compound Name

1-[4-(2-cyclopropyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazino]-3,3-dimethyl-1-butanone

IUPAC name

1-(4-{5-cyclopropyl-8-thia-46-diazatricyclo[7.5.0.0^{27}]tetradeca-1(9)2(7)35-tetraen-3-yl}piperazin-1-yl)-33-dimethylbutan-1-one

SMILES

CC(C)(C)CC(N(CC1)CCN1c1c(c(CCCCC2)c2s2)c2nc(C2CC2)n1)=O

InChI

InChI=1S/C24H34N4OS/c1-24(2,3)15-19(29)27-11-13-28(14-12-27)22-20-17-7-5-4-6-8-18(17)30-23(20)26-21(25-22)16-9-10-16/h16H,4-15H2,1-3H3

InChI Key

NBPOXVJDNRDSHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19852351

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

426.63

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.297

Distribution Coefficient, logD

4.572

Water Solubility, LogSw

-5.49

Polar Surface Area

40.003

Acid Dissociation Constant (pKa)

22.62

Base Dissociation Constant (pKb)

9.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

70.80

V017-5977 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V017-5977 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-5977?
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What is the minimum amount of V017-5977 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-5977
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-5977
  • 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 V017-5977 available by request