D305-1182 Screening compound: N-{1-methyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-carboxamide
Chemical Structure Depiction of ChemDiv screening compound D305-1182
N-{1-methyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-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
D305-1182
Molecular Formula
C19H22N4O2 (C19 H22 N4 O2)
Compound Name
N-{1-methyl-2-[(piperidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}furan-2-carboxamide
IUPAC name
N-{1-methyl-2-[(piperidin-1-yl)methyl]-1H-13-benzodiazol-5-yl}furan-2-carboxamide
SMILES
Cn1c(ccc(NC(c2ccco2)=O)c2)c2nc1CN1CCCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
338.41
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.577
Distribution Coefficient, logD
2.337
Water Solubility, LogSw
-2.92
Polar Surface Area
47.627
Acid Dissociation Constant (pKa)
11.43
Base Dissociation Constant (pKb)
7.27
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
36.80
D305-1182 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- GPCR
- Receptor's ligands
References: we are preparing a list of scientific research reports with D305-1182 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)