G554-0479 Screening compound: N-[2-(piperidin-1-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of ChemDiv screening compound G554-0479
N-[2-(piperidin-1-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide
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
G554-0479
Molecular Formula
C22H34N4O3S (C22 H34 N4 O3 S)
Compound Name
N-[2-(piperidin-1-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide
IUPAC name
N-[2-(piperidin-1-yl)ethyl]-4-(pyrrolidin-1-yl)-3-(pyrrolidine-1-sulfonyl)benzamide
SMILES
O=C(c(cc1)cc(S(N2CCCC2)(=O)=O)c1N1CCCC1)NCCN1CCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
434.6
Hydrogen Bond Acceptors Count
8.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.394
Distribution Coefficient, logD
1.394
Water Solubility, LogSw
-2.92
Polar Surface Area
64.070
Acid Dissociation Constant (pKa)
11.63
Base Dissociation Constant (pKb)
8.35
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
68.20
G554-0479 in Drug Discovery
Included in Screening Libraries
Anti-Inflammatory Library (24602 compounds)
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Immune system
- Cancer
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with G554-0479 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of G554-0479, 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.
Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)