8640-0483 Screening compound: N,N-dibutyl-N-[2,2-dimethyl-5-(1-pyrrolidinyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amine

8640-0483 Screening compound: N,N-dibutyl-N-[2,2-dimethyl-5-(1-pyrrolidinyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amine
8640-0483 Screening compound: N,N-dibutyl-N-[2,2-dimethyl-5-(1-pyrrolidinyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8640-0483
N,N-dibutyl-N-[2,2-dimethyl-5-(1-pyrrolidinyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amine

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

8640-0483

Molecular Formula

C26H37N5OS (C26 H37 N5 OS)

Compound Name

N,N-dibutyl-N-[2,2-dimethyl-5-(1-pyrrolidinyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amine

IUPAC name

NN-dibutyl-44-dimethyl-8-(pyrrolidin-1-yl)-5-oxa-11-thia-91416-triazatetracyclo[8.7.0.0^{27}.0^{1217}]heptadeca-1(10)2(7)812(17)1315-hexaen-13-amine

SMILES

CCCCN(CCCC)c1c2sc3nc(N4CCCC4)c(COC(C)(C)C4)c4c3c2ncn1

InChI

InChI=1S/C26H37N5OS/c1-5-7-11-31(12-8-6-2)24-22-21(27-17-28-24)20-18-15-26(3,4)32-16-19(18)23(29-25(20)33-22)30-13-9-10-14-30/h17H,5-16H2,1-4H3

InChI Key

UYVAXYSBILFBSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03009272

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.68

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.718

Distribution Coefficient, logD

7.690

Water Solubility, LogSw

-5.95

Polar Surface Area

44.800

Acid Dissociation Constant (pKa)

21.65

Base Dissociation Constant (pKb)

6.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.40

8640-0483 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8640-0483 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8640-0483?
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What is the minimum amount of 8640-0483 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8640-0483
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8640-0483
  • 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 8640-0483 available by request