C857-1833 Screening compound: 1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2,5-dimethylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of ChemDiv screening compound C857-1833
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2,5-dimethylphenyl)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
C857-1833
Molecular Formula
C22H27N5OS (C22 H27 N5 OS)
Compound Name
1-[5-(2,5-dimethyl-1H-pyrrol-1-yl)-1,3,4-thiadiazol-2-yl]-N-(2,5-dimethylphenyl)piperidine-4-carboxamide
IUPAC name
1-[5-(25-dimethyl-1H-pyrrol-1-yl)-134-thiadiazol-2-yl]-N-(25-dimethylphenyl)piperidine-4-carboxamide
SMILES
Cc1ccc(C)n1-c1nnc(N(CC2)CCC2C(Nc2c(C)ccc(C)c2)=O)s1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.56
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.700
Distribution Coefficient, logD
3.700
Water Solubility, LogSw
-3.61
Polar Surface Area
52.107
Acid Dissociation Constant (pKa)
12.02
Base Dissociation Constant (pKb)
2.76
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.90
References: we are preparing a list of scientific research reports with C857-1833 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)