C060-0118 Screening compound: N-{3-[benzyl(ethyl)amino]propyl}-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide

C060-0118 Screening compound: N-{3-[benzyl(ethyl)amino]propyl}-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide
C060-0118 Screening compound: N-{3-[benzyl(ethyl)amino]propyl}-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C060-0118
N-{3-[benzyl(ethyl)amino]propyl}-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide

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

C060-0118

Molecular Formula

C26H35N5O3S (C26 H35 N5 O3 S)

Compound Name

N-{3-[benzyl(ethyl)amino]propyl}-4-(2-{5,6-dimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidin-3-yl}acetamido)butanamide

IUPAC name

N-{3-[benzyl(ethyl)amino]propyl}-4-(2-{56-dimethyl-4-oxo-3H4H-thieno[23-d]pyrimidin-3-yl}acetamido)butanamide

SMILES

CCN(CCCNC(CCCNC(CN(C=Nc1c2c(C)c(C)s1)C2=O)=O)=O)Cc1ccccc1

InChI

InChI=1S/C26H35N5O3S/c1-4-30(16-21-10-6-5-7-11-21)15-9-14-27-22(32)12-8-13-28-23(33)17-31-18-29-25-24(26(31)34)19(2)20(3)35-25/h5-7,10-11,18H,4,8-9,12-17H2,1-3H3,(H,27,32)(H,28,33)

InChI Key

OGKPFHSWBHIAOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14714238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.404

Distribution Coefficient, logD

-0.243

Water Solubility, LogSw

-2.28

Polar Surface Area

78.554

Acid Dissociation Constant (pKa)

15.52

Base Dissociation Constant (pKb)

9.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

C060-0118 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with C060-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C060-0118?
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What is the minimum amount of C060-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C060-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C060-0118
  • 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 C060-0118 available by request