8018-9386 Screening compound: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)propyl]-N-methylamine

8018-9386 Screening compound: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)propyl]-N-methylamine
8018-9386 Screening compound: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)propyl]-N-methylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-9386
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)propyl]-N-methylamine

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

8018-9386

Molecular Formula

C27H26ClN3S (C27 H26 ClN3 S)

Compound Name

N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-[3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)propyl]-N-methylamine

IUPAC name

N-(3-{2-azatricyclo[9.4.0.0^{38}]pentadeca-1(11)3(8)461214-hexaen-2-yl}propyl)-4-(4-chlorophenyl)-N-methyl-13-thiazol-2-amine

SMILES

CN(CCCN(c1c(CC2)cccc1)c1c2cccc1)c1nc(-c(cc2)ccc2Cl)cs1

InChI

InChI=1S/C27H26ClN3S/c1-30(27-29-24(19-32-27)20-13-15-23(28)16-14-20)17-6-18-31-25-9-4-2-7-21(25)11-12-22-8-3-5-10-26(22)31/h2-5,7-10,13-16,19H,6,11-12,17-18H2,1H3

InChI Key

WFLBJLNJTTUFDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06668100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.04

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

8.745

Distribution Coefficient, logD

8.745

Water Solubility, LogSw

-6.71

Polar Surface Area

14.348

Acid Dissociation Constant (pKa)

22.38

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8018-9386 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

MCL1 Targeted Library (12200 compounds)

Regenerative Medicine Focused Library (23016 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-9386 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-9386?
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What is the minimum amount of 8018-9386 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-9386
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-9386
  • 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 8018-9386 available by request