C336-0150 Screening compound: 2-[5-({2-[(2-CHLOROBENZYL)AMINO]-2-OXOETHYL}SULFANYL)-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL]-N~1~-CYCLOHEXYLACETAMIDE

C336-0150 Screening compound: 2-[5-({2-[(2-CHLOROBENZYL)AMINO]-2-OXOETHYL}SULFANYL)-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL]-N~1~-CYCLOHEXYLACETAMIDE
C336-0150 Screening compound: 2-[5-({2-[(2-CHLOROBENZYL)AMINO]-2-OXOETHYL}SULFANYL)-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL]-N~1~-CYCLOHEXYLACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C336-0150
2-[5-({2-[(2-CHLOROBENZYL)AMINO]-2-OXOETHYL}SULFANYL)-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL]-N~1~-CYCLOHEXYLACETAMIDE

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

C336-0150

Molecular Formula

C27H28ClN5O3S (C27 H28 ClN5 O3 S)

Compound Name

2-[5-({2-[(2-CHLOROBENZYL)AMINO]-2-OXOETHYL}SULFANYL)-2-OXO-2,3-DIHYDROIMIDAZO[1,2-C]QUINAZOLIN-3-YL]-N~1~-CYCLOHEXYLACETAMIDE

IUPAC name

n/a

SMILES

O=C(CC1N2C(SCC(NCc(cccc3)c3Cl)=O)=Nc(cccc3)c3C2=NC1=O)NC1CCCCC1

InChI

InChI=1S/C27H28ClN5O3S/c28-20-12-6-4-8-17(20)15-29-24(35)16-37-27-31-21-13-7-5-11-19(21)25-32-26(36)22(33(25)27)14-23(34)30-18-9-2-1-3-10-18/h4-8,11-13,18,22H,1-3,9-10,14-16H2,(H,29,35)(H,30,34)/t22-/m0/s1

InChI Key

RGXQZZLTLFUUDH-QFIPXVFZSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

538.07

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.702

Distribution Coefficient, logD

3.701

Water Solubility, LogSw

-4.17

Polar Surface Area

83.820

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

4.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

C336-0150 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 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 C336-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C336-0150?
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What is the minimum amount of C336-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C336-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C336-0150
  • 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 C336-0150 available by request