M381-2821 Screening compound: 5-methyl-N-[4-(pyrrolidin-1-yl)quinazolin-6-yl]thiophene-2-carboxamide

M381-2821 Screening compound: 5-methyl-N-[4-(pyrrolidin-1-yl)quinazolin-6-yl]thiophene-2-carboxamide
M381-2821 Screening compound: 5-methyl-N-[4-(pyrrolidin-1-yl)quinazolin-6-yl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M381-2821
5-methyl-N-[4-(pyrrolidin-1-yl)quinazolin-6-yl]thiophene-2-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

M381-2821

Molecular Formula

C18H18N4OS (C18 H18 N4 OS)

Compound Name

5-methyl-N-[4-(pyrrolidin-1-yl)quinazolin-6-yl]thiophene-2-carboxamide

IUPAC name

5-methyl-N-[4-(pyrrolidin-1-yl)quinazolin-6-yl]thiophene-2-carboxamide

SMILES

Cc1ccc(C(Nc2cc3c(N4CCCC4)ncnc3cc2)=O)s1

InChI

InChI=1S/C18H18N4OS/c1-12-4-7-16(24-12)18(23)21-13-5-6-15-14(10-13)17(20-11-19-15)22-8-2-3-9-22/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,23)

InChI Key

FOXUUWUKTUSKTQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27539819

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.421

Distribution Coefficient, logD

4.419

Water Solubility, LogSw

-4.19

Polar Surface Area

47.624

Acid Dissociation Constant (pKa)

11.48

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

M381-2821 in Drug Discovery

Included in Screening Libraries

Hsp90-Targeted Library (11355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with M381-2821 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M381-2821?
Check Price and Availability of M381-2821, 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 M381-2821 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M381-2821
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M381-2821
  • 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 M381-2821 available by request