C799-0300 Screening compound: 1-[(1-cyclopentyl-2-methyl-1H-1,3-benzodiazol-5-yl)sulfonyl]-N-(2-ethylphenyl)piperidine-4-carboxamide

C799-0300 Screening compound: 1-[(1-cyclopentyl-2-methyl-1H-1,3-benzodiazol-5-yl)sulfonyl]-N-(2-ethylphenyl)piperidine-4-carboxamide
C799-0300 Screening compound: 1-[(1-cyclopentyl-2-methyl-1H-1,3-benzodiazol-5-yl)sulfonyl]-N-(2-ethylphenyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C799-0300
1-[(1-cyclopentyl-2-methyl-1H-1,3-benzodiazol-5-yl)sulfonyl]-N-(2-ethylphenyl)piperidine-4-carboxamide

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

C799-0300

Molecular Formula

C27H34N4O3S (C27 H34 N4 O3 S)

Compound Name

1-[(1-cyclopentyl-2-methyl-1H-1,3-benzodiazol-5-yl)sulfonyl]-N-(2-ethylphenyl)piperidine-4-carboxamide

IUPAC name

1-[(1-cyclopentyl-2-methyl-1H-13-benzodiazol-5-yl)sulfonyl]-N-(2-ethylphenyl)piperidine-4-carboxamide

SMILES

CCc(cccc1)c1NC(C(CC1)CCN1S(c(cc1)cc2c1n(C1CCCC1)c(C)n2)(=O)=O)=O

InChI

InChI=1S/C27H34N4O3S/c1-3-20-8-4-7-11-24(20)29-27(32)21-14-16-30(17-15-21)35(33,34)23-12-13-26-25(18-23)28-19(2)31(26)22-9-5-6-10-22/h4,7-8,11-13,18,21-22H,3,5-6,9-10,14-17H2,1-2H3,(H,29,32)

InChI Key

OLZBBBDXERQOLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14799448

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.66

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.567

Distribution Coefficient, logD

4.567

Water Solubility, LogSw

-4.26

Polar Surface Area

65.991

Acid Dissociation Constant (pKa)

12.28

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.10

References: we are preparing a list of scientific research reports with C799-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C799-0300?
Check Price and Availability of C799-0300, 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 C799-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C799-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C799-0300
  • 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 C799-0300 available by request