V012-0497 Screening compound: ethyl 1-{4-heptanamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

V012-0497 Screening compound: ethyl 1-{4-heptanamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate
V012-0497 Screening compound: ethyl 1-{4-heptanamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-0497
ethyl 1-{4-heptanamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-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

V012-0497

Molecular Formula

C29H41N3O5S (C29 H41 N3 O5 S)

Compound Name

ethyl 1-{4-heptanamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

IUPAC name

ethyl 1-{4-heptanamido-2-[(1-phenylethyl)sulfamoyl]phenyl}piperidine-3-carboxylate

SMILES

CCCCCCC(Nc(cc1)cc(S(NC(C)c2ccccc2)(=O)=O)c1N(CCC1)CC1C(OCC)=O)=O

InChI

InChI=1S/C29H41N3O5S/c1-4-6-7-11-16-28(33)30-25-17-18-26(32-19-12-15-24(21-32)29(34)37-5-2)27(20-25)38(35,36)31-22(3)23-13-9-8-10-14-23/h8-10,13-14,17-18,20,22,24,31H,4-7,11-12,15-16,19,21H2,1-3H3,(H,30,33)

InChI Key

FSVWMTLWZMGOIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972699

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

543.73

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.639

Distribution Coefficient, logD

5.638

Water Solubility, LogSw

-5.19

Polar Surface Area

88.361

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

1.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

51.70

References: we are preparing a list of scientific research reports with V012-0497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-0497?
Check Price and Availability of V012-0497, 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 V012-0497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-0497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-0497
  • 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 V012-0497 available by request