Y030-9498 Screening compound: N-[4-(azepane-1-sulfonyl)phenyl]-5-chloro-2-methoxybenzamide

Y030-9498 Screening compound: N-[4-(azepane-1-sulfonyl)phenyl]-5-chloro-2-methoxybenzamide
Y030-9498 Screening compound: N-[4-(azepane-1-sulfonyl)phenyl]-5-chloro-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-9498
N-[4-(azepane-1-sulfonyl)phenyl]-5-chloro-2-methoxybenzamide

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

Y030-9498

Molecular Formula

C20H23ClN2O4S (C20 H23 ClN2 O4 S)

Compound Name

N-[4-(azepane-1-sulfonyl)phenyl]-5-chloro-2-methoxybenzamide

IUPAC name

N-[4-(azepane-1-sulfonyl)phenyl]-5-chloro-2-methoxybenzamide

SMILES

COc(ccc(Cl)c1)c1C(Nc(cc1)ccc1S(N1CCCCCC1)(=O)=O)=O

InChI

InChI=1S/C20H23ClN2O4S/c1-27-19-11-6-15(21)14-18(19)20(24)22-16-7-9-17(10-8-16)28(25,26)23-12-4-2-3-5-13-23/h6-11,14H,2-5,12-13H2,1H3,(H,22,24)

InChI Key

OJTQBDHKALLNMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05661141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.93

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.278

Distribution Coefficient, logD

3.403

Water Solubility, LogSw

-4.53

Polar Surface Area

63.002

Acid Dissociation Constant (pKa)

6.59

Base Dissociation Constant (pKb)

-3.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with Y030-9498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-9498?
Check Price and Availability of Y030-9498, 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 Y030-9498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-9498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-9498
  • 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 Y030-9498 available by request