4852-0683 Screening compound: N-[3-(diethylamino)propyl]-N-(6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

4852-0683 Screening compound: N-[3-(diethylamino)propyl]-N-(6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine
4852-0683 Screening compound: N-[3-(diethylamino)propyl]-N-(6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4852-0683
N-[3-(diethylamino)propyl]-N-(6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-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

4852-0683

Molecular Formula

C18H28N4S (C18 H28 N4 S)

Compound Name

N-[3-(diethylamino)propyl]-N-(6-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)amine

IUPAC name

N-[3-(diethylamino)propyl]-12-methyl-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraen-3-amine

SMILES

CCN(CC)CCCNc1c(c(CC(C)CC2)c2s2)c2ncn1

InChI

InChI=1S/C18H28N4S/c1-4-22(5-2)10-6-9-19-17-16-14-11-13(3)7-8-15(14)23-18(16)21-12-20-17/h12-13H,4-11H2,1-3H3,(H,19,20,21)/t13-/m1/s1

InChI Key

FKKFHMOVGAKEOG-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD03663789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.488

Distribution Coefficient, logD

2.247

Water Solubility, LogSw

-4.28

Polar Surface Area

35.472

Acid Dissociation Constant (pKa)

17.75

Base Dissociation Constant (pKb)

9.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

4852-0683 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4852-0683 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4852-0683?
Check Price and Availability of 4852-0683, 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 4852-0683 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4852-0683
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4852-0683
  • 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 4852-0683 available by request