L077-0006 Screening compound: 4-{5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-phenylpiperidine-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound L077-0006
4-{5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-phenylpiperidine-1-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
L077-0006
Molecular Formula
C22H23N5O3S (C22 H23 N5 O3 S)
Compound Name
4-{5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-phenylpiperidine-1-carboxamide
IUPAC name
4-{5-[(4-methoxyphenyl)carbamoyl]-134-thiadiazol-2-yl}-N-phenylpiperidine-1-carboxamide
SMILES
COc(cc1)ccc1NC(c1nnc(C(CC2)CCN2C(Nc2ccccc2)=O)s1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
437.52
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
8.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.265
Distribution Coefficient, logD
3.265
Water Solubility, LogSw
-3.50
Polar Surface Area
79.575
Acid Dissociation Constant (pKa)
11.08
Base Dissociation Constant (pKb)
1.86
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
27.30
L077-0006 in Drug Discovery
Included in Screening Libraries
Protein Kinases Inhibitors Library (36801 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Nervous system
- Hemic and lymphatic
- Cardiovascular
- Kinases
References: we are preparing a list of scientific research reports with L077-0006 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)