G895-0963 Screening compound: 2,5-dimethyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

G895-0963 Screening compound: 2,5-dimethyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
G895-0963 Screening compound: 2,5-dimethyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G895-0963
2,5-dimethyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

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

G895-0963

Molecular Formula

C21H24N4OS2 (C21 H24 N4 OS2)

Compound Name

2,5-dimethyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide

IUPAC name

25-dimethyl-N-{[4-(methylsulfanyl)phenyl]methyl}-4-(pyrrolidin-1-yl)thieno[23-d]pyrimidine-6-carboxamide

SMILES

Cc1c(C(NCc(cc2)ccc2SC)=O)sc2nc(C)nc(N3CCCC3)c12

InChI

InChI=1S/C21H24N4OS2/c1-13-17-19(25-10-4-5-11-25)23-14(2)24-21(17)28-18(13)20(26)22-12-15-6-8-16(27-3)9-7-15/h6-9H,4-5,10-12H2,1-3H3,(H,22,26)

InChI Key

WCQUJVINZZJAPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.924

Distribution Coefficient, logD

4.497

Water Solubility, LogSw

-4.75

Polar Surface Area

47.692

Acid Dissociation Constant (pKa)

11.16

Base Dissociation Constant (pKb)

7.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with G895-0963 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G895-0963?
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What is the minimum amount of G895-0963 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G895-0963
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G895-0963
  • 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 G895-0963 available by request