F379-1695 Screening compound: N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide

F379-1695 Screening compound: N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
F379-1695 Screening compound: N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F379-1695
N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-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

F379-1695

Molecular Formula

C21H27N3O4S (C21 H27 N3 O4 S)

Compound Name

N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide

IUPAC name

N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-35-dimethyl-1H-pyrrole-2-carboxamide

SMILES

CC(c1cccc(NC(c2c(C)c(S(N3CCCCCC3)(=O)=O)c(C)[nH]2)=O)c1)=O

InChI

InChI=1S/C21H27N3O4S/c1-14-19(21(26)23-18-10-8-9-17(13-18)16(3)25)22-15(2)20(14)29(27,28)24-11-6-4-5-7-12-24/h8-10,13,22H,4-7,11-12H2,1-3H3,(H,23,26)

InChI Key

XNXAAJKVQBGKDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27121487

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.021

Distribution Coefficient, logD

3.013

Water Solubility, LogSw

-3.41

Polar Surface Area

80.180

Acid Dissociation Constant (pKa)

9.11

Base Dissociation Constant (pKb)

-2.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with F379-1695 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F379-1695?
Check Price and Availability of F379-1695, 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 F379-1695 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F379-1695
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F379-1695
  • 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 F379-1695 available by request