C201-0370 Screening compound: (2Z)-2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide
Chemical Structure Depiction of ChemDiv screening compound C201-0370
(2Z)-2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide
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
C201-0370
Molecular Formula
C17H14ClN3O2S (C17 H14 ClN3 O2 S)
Compound Name
(2Z)-2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[2,3-c]pyridine-3-carbothioamide
IUPAC name
(2Z)-2-[(3-chlorophenyl)imino]-5-(hydroxymethyl)-8-methyl-2H-pyrano[23-c]pyridine-3-carbothioamide
SMILES
Cc1ncc(CO)c(C=C2C(N)=S)c1O/C2=N\c1cccc(Cl)c1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
359.84
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
3.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
2.449
Distribution Coefficient, logD
2.449
Water Solubility, LogSw
-2.92
Polar Surface Area
61.912
Acid Dissociation Constant (pKa)
14.99
Base Dissociation Constant (pKb)
2.68
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.80
C201-0370 in Drug Discovery
Included in Screening Libraries
Chelators targeting matrix metalloproteinases library (8930 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Cardiovascular
- Proteases
References: we are preparing a list of scientific research reports with C201-0370 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)