6145-0184 Screening compound: 4-(tert-butyl)-N~1~-(cyclohexylcarbonyl)-N~1~-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-1-benzenesulfonamide

6145-0184 Screening compound: 4-(tert-butyl)-N~1~-(cyclohexylcarbonyl)-N~1~-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-1-benzenesulfonamide
6145-0184 Screening compound: 4-(tert-butyl)-N~1~-(cyclohexylcarbonyl)-N~1~-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6145-0184
4-(tert-butyl)-N~1~-(cyclohexylcarbonyl)-N~1~-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-1-benzenesulfonamide

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

6145-0184

Molecular Formula

C29H35NO4S (C29 H35 NO4 S)

Compound Name

4-(tert-butyl)-N~1~-(cyclohexylcarbonyl)-N~1~-(6,7,8,9-tetrahydrodibenzo[b,d]furan-2-yl)-1-benzenesulfonamide

IUPAC name

N-(4-tert-butylbenzenesulfonyl)-N-{8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)246-tetraen-4-yl}cyclohexanecarboxamide

SMILES

CC(C)(C)c(cc1)ccc1S(N(C(C1CCCCC1)=O)c(cc1)cc2c1oc1c2CCCC1)(=O)=O

InChI

InChI=1S/C29H35NO4S/c1-29(2,3)21-13-16-23(17-14-21)35(32,33)30(28(31)20-9-5-4-6-10-20)22-15-18-27-25(19-22)24-11-7-8-12-26(24)34-27/h13-20H,4-12H2,1-3H3

InChI Key

BLMCKJJNDFRIFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05717313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.541

Distribution Coefficient, logD

7.541

Water Solubility, LogSw

-5.56

Polar Surface Area

53.854

Acid Dissociation Constant (pKa)

19.87

Base Dissociation Constant (pKb)

-13.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.30

6145-0184 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 6145-0184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6145-0184?
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What is the minimum amount of 6145-0184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6145-0184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6145-0184
  • 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 6145-0184 available by request