0099-0234 Screening compound: 2-({4-[(1E)-2-(2,6-dichloro-4-nitrophenyl)diazen-1-yl]phenyl}(ethyl)amino)ethan-1-ol

0099-0234 Screening compound: 2-({4-[(1E)-2-(2,6-dichloro-4-nitrophenyl)diazen-1-yl]phenyl}(ethyl)amino)ethan-1-ol
0099-0234 Screening compound: 2-({4-[(1E)-2-(2,6-dichloro-4-nitrophenyl)diazen-1-yl]phenyl}(ethyl)amino)ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0099-0234
2-({4-[(1E)-2-(2,6-dichloro-4-nitrophenyl)diazen-1-yl]phenyl}(ethyl)amino)ethan-1-ol

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

0099-0234

Molecular Formula

C16H16Cl2N4O3 (C16 H16 Cl2 N4 O3)

Compound Name

2-({4-[(1E)-2-(2,6-dichloro-4-nitrophenyl)diazen-1-yl]phenyl}(ethyl)amino)ethan-1-ol

IUPAC name

2-({4-[(1E)-2-(26-dichloro-4-nitrophenyl)diazen-1-yl]phenyl}(ethyl)amino)ethan-1-ol

SMILES

CCN(CCO)c(cc1)ccc1/N=N/c(c(Cl)cc([N+]([O-])=O)c1)c1Cl

InChI

InChI=1S/C16H16Cl2N4O3/c1-2-21(7-8-23)12-5-3-11(4-6-12)19-20-16-14(17)9-13(22(24)25)10-15(16)18/h3-6,9-10,23H,2,7-8H2,1H3

InChI Key

IZKMDTFNKCYTOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00181821

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.23

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.150

Distribution Coefficient, logD

5.150

Water Solubility, LogSw

-5.52

Polar Surface Area

73.557

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

3.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

0099-0234 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0099-0234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0099-0234?
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What is the minimum amount of 0099-0234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0099-0234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0099-0234
  • 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 0099-0234 available by request