Y600-0982 Screening compound: N-(4-chloro-2,5-dimethoxyphenyl)-N'-cyclopentylthiourea
Chemical Structure Depiction of ChemDiv screening compound Y600-0982
N-(4-chloro-2,5-dimethoxyphenyl)-N'-cyclopentylthiourea
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
Y600-0982
Molecular Formula
C14H19ClN2O2S (C14 H19 ClN2 O2 S)
Compound Name
N-(4-chloro-2,5-dimethoxyphenyl)-N'-cyclopentylthiourea
IUPAC name
1-(4-chloro-25-dimethoxyphenyl)-3-cyclopentylthiourea
SMILES
COc(c(NC(NC1CCCC1)=S)c1)cc(Cl)c1OC
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
314.84
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
3.862
Distribution Coefficient, logD
3.862
Water Solubility, LogSw
-4.15
Polar Surface Area
35.037
Acid Dissociation Constant (pKa)
11.08
Base Dissociation Constant (pKb)
1.94
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
50.00
Y600-0982 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with Y600-0982 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)