L904-0816 Screening compound: N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3,5-dimethylbenzene-1-sulfonamide

L904-0816 Screening compound: N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3,5-dimethylbenzene-1-sulfonamide
L904-0816 Screening compound: N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3,5-dimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L904-0816
N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3,5-dimethylbenzene-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

L904-0816

Molecular Formula

C22H19ClN2O2S2 (C22 H19 ClN2 O2 S2)

Compound Name

N-[3-chloro-4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3,5-dimethylbenzene-1-sulfonamide

IUPAC name

N-[3-chloro-4-(6-methyl-13-benzothiazol-2-yl)phenyl]-35-dimethylbenzene-1-sulfonamide

SMILES

Cc(cc1)cc2c1nc(-c(ccc(NS(c1cc(C)cc(C)c1)(=O)=O)c1)c1Cl)s2

InChI

InChI=1S/C22H19ClN2O2S2/c1-13-4-7-20-21(11-13)28-22(24-20)18-6-5-16(12-19(18)23)25-29(26,27)17-9-14(2)8-15(3)10-17/h4-12,25H,1-3H3

InChI Key

JXAUJQVFGMPEMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27485602

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.99

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.844

Distribution Coefficient, logD

6.524

Water Solubility, LogSw

-6.70

Polar Surface Area

50.337

Acid Dissociation Constant (pKa)

7.36

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with L904-0816 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L904-0816?
Check Price and Availability of L904-0816, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L904-0816 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L904-0816
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L904-0816
  • 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 L904-0816 available by request