D030-0150 Screening compound: methyl 4-{[2-(4-methylbenzenesulfonamido)cyclohexyl]amino}benzoate

D030-0150 Screening compound: methyl 4-{[2-(4-methylbenzenesulfonamido)cyclohexyl]amino}benzoate
D030-0150 Screening compound: methyl 4-{[2-(4-methylbenzenesulfonamido)cyclohexyl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D030-0150
methyl 4-{[2-(4-methylbenzenesulfonamido)cyclohexyl]amino}benzoate

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

D030-0150

Molecular Formula

C21H26N2O4S (C21 H26 N2 O4 S)

Compound Name

methyl 4-{[2-(4-methylbenzenesulfonamido)cyclohexyl]amino}benzoate

IUPAC name

methyl 4-{[2-(4-methylbenzenesulfonamido)cyclohexyl]amino}benzoate

SMILES

Cc(cc1)ccc1S(NC(CCCC1)C1Nc(cc1)ccc1C(OC)=O)(=O)=O

InChI

InChI=1S/C21H26N2O4S/c1-15-7-13-18(14-8-15)28(25,26)23-20-6-4-3-5-19(20)22-17-11-9-16(10-12-17)21(24)27-2/h7-14,19-20,22-23H,3-6H2,1-2H3

InChI Key

XGVKXHIPMNWKCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.830

Distribution Coefficient, logD

4.830

Water Solubility, LogSw

-4.63

Polar Surface Area

73.657

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with D030-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D030-0150?
Check Price and Availability of D030-0150, 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 D030-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D030-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D030-0150
  • 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 D030-0150 available by request