D030-1070 Screening compound: 4-chloro-N-(2-{cyclohexyl[(furan-2-yl)methyl]amino}cyclohexyl)benzene-1-sulfonamide

D030-1070 Screening compound: 4-chloro-N-(2-{cyclohexyl[(furan-2-yl)methyl]amino}cyclohexyl)benzene-1-sulfonamide
D030-1070 Screening compound: 4-chloro-N-(2-{cyclohexyl[(furan-2-yl)methyl]amino}cyclohexyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D030-1070
4-chloro-N-(2-{cyclohexyl[(furan-2-yl)methyl]amino}cyclohexyl)benzene-1-sulfonamide

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

D030-1070

Molecular Formula

C23H31ClN2O3S (C23 H31 ClN2 O3 S)

Compound Name

4-chloro-N-(2-{cyclohexyl[(furan-2-yl)methyl]amino}cyclohexyl)benzene-1-sulfonamide

IUPAC name

4-chloro-N-(2-{cyclohexyl[(furan-2-yl)methyl]amino}cyclohexyl)benzene-1-sulfonamide

SMILES

O=S(c(cc1)ccc1Cl)(NC(CCCC1)C1N(Cc1ccco1)C1CCCCC1)=O

InChI

InChI=1S/C23H31ClN2O3S/c24-18-12-14-21(15-13-18)30(27,28)25-22-10-4-5-11-23(22)26(17-20-9-6-16-29-20)19-7-2-1-3-8-19/h6,9,12-16,19,22-23,25H,1-5,7-8,10-11,17H2

InChI Key

ZTYVUZQQMXWRKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811224

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

451.03

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.920

Distribution Coefficient, logD

5.869

Water Solubility, LogSw

-6.24

Polar Surface Area

51.169

Acid Dissociation Constant (pKa)

11.71

Base Dissociation Constant (pKb)

6.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

56.50

D030-1070 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D030-1070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D030-1070?
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What is the minimum amount of D030-1070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D030-1070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D030-1070
  • 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 D030-1070 available by request