4953-2105 Screening compound: (Z)-[amino(2,4-dichlorophenyl)methylidene]amino 10H-phenothiazine-10-carboxylate

4953-2105 Screening compound: (Z)-[amino(2,4-dichlorophenyl)methylidene]amino 10H-phenothiazine-10-carboxylate
4953-2105 Screening compound: (Z)-[amino(2,4-dichlorophenyl)methylidene]amino 10H-phenothiazine-10-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4953-2105
(Z)-[amino(2,4-dichlorophenyl)methylidene]amino 10H-phenothiazine-10-carboxylate

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

4953-2105

Molecular Formula

C20H13Cl2N3O2S (C20 H13 Cl2 N3 O2 S)

Compound Name

(Z)-[amino(2,4-dichlorophenyl)methylidene]amino 10H-phenothiazine-10-carboxylate

IUPAC name

(Z)-[amino(24-dichlorophenyl)methylidene]amino 10H-phenothiazine-10-carboxylate

SMILES

N/C(/c(ccc(Cl)c1)c1Cl)=N\OC(N1c(cccc2)c2Sc2c1cccc2)=O

InChI

InChI=1S/C20H13Cl2N3O2S/c21-12-9-10-13(14(22)11-12)19(23)24-27-20(26)25-15-5-1-3-7-17(15)28-18-8-4-2-6-16(18)25/h1-11H,(H2,23,24)

InChI Key

OQJZSEOBQYODCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03253512

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.325

Distribution Coefficient, logD

5.325

Water Solubility, LogSw

-6.04

Polar Surface Area

51.311

Acid Dissociation Constant (pKa)

11.30

Base Dissociation Constant (pKb)

-0.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4953-2105 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 4953-2105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4953-2105?
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What is the minimum amount of 4953-2105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4953-2105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4953-2105
  • 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 4953-2105 available by request