L936-0299 Screening compound: 2-[4-(diethylamino)-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(3-methylbutyl)acetamide

L936-0299 Screening compound: 2-[4-(diethylamino)-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(3-methylbutyl)acetamide
L936-0299 Screening compound: 2-[4-(diethylamino)-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(3-methylbutyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L936-0299
2-[4-(diethylamino)-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(3-methylbutyl)acetamide

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

L936-0299

Molecular Formula

C23H31N5O (C23 H31 N5 O)

Compound Name

2-[4-(diethylamino)-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-5-yl]-N-(3-methylbutyl)acetamide

IUPAC name

2-[4-(diethylamino)-7-phenyl-5H-pyrrolo[32-d]pyrimidin-5-yl]-N-(3-methylbutyl)acetamide

SMILES

CCN(CC)c(ncnc12)c1n(CC(NCCC(C)C)=O)cc2-c1ccccc1

InChI

InChI=1S/C23H31N5O/c1-5-27(6-2)23-22-21(25-16-26-23)19(18-10-8-7-9-11-18)14-28(22)15-20(29)24-13-12-17(3)4/h7-11,14,16-17H,5-6,12-13,15H2,1-4H3,(H,24,29)

InChI Key

GVJYZABBAMDVDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27488533

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.163

Distribution Coefficient, logD

2.843

Water Solubility, LogSw

-3.94

Polar Surface Area

49.296

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

8.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

L936-0299 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with L936-0299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L936-0299?
Check Price and Availability of L936-0299, 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 L936-0299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L936-0299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L936-0299
  • 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 L936-0299 available by request