M687-2990 Screening compound: N~1~-(4-bromobenzyl)-3-[3,5-dimethyl-4-(piperidinocarbonyl)-1H-pyrrol-2-yl]propanamide
Chemical Structure Depiction of ChemDiv screening compound M687-2990
N~1~-(4-bromobenzyl)-3-[3,5-dimethyl-4-(piperidinocarbonyl)-1H-pyrrol-2-yl]propanamide
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
M687-2990
Molecular Formula
C22H28BrN3O2 (C22 H28 BrN3 O2)
Compound Name
N~1~-(4-bromobenzyl)-3-[3,5-dimethyl-4-(piperidinocarbonyl)-1H-pyrrol-2-yl]propanamide
IUPAC name
n/a
SMILES
Cc1c(CCC(NCc(cc2)ccc2Br)=O)[nH]c(C)c1C(N1CCCCC1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
446.39
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
3.518
Distribution Coefficient, logD
3.518
Water Solubility, LogSw
-3.70
Polar Surface Area
52.563
Acid Dissociation Constant (pKa)
12.32
Base Dissociation Constant (pKb)
-0.66
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
45.50
M687-2990 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
GPCR Targeted Library (31838 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
- Agro
References: we are preparing a list of scientific research reports with M687-2990 chemical compound. It will be published here after verification.
Frequently Asked Questions
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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)