C340-0346 Screening compound: 1-[3-(2-ethylpiperidin-1-yl)propyl]-3-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]thiourea
Chemical Structure Depiction of ChemDiv screening compound C340-0346
1-[3-(2-ethylpiperidin-1-yl)propyl]-3-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]thiourea
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
C340-0346
Molecular Formula
C25H37N5OS (C25 H37 N5 OS)
Compound Name
1-[3-(2-ethylpiperidin-1-yl)propyl]-3-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]thiourea
IUPAC name
1-[3-(2-ethylpiperidin-1-yl)propyl]-3-[4-methyl-2-(morpholin-4-yl)quinolin-6-yl]thiourea
SMILES
CCC1N(CCCNC(Nc2cc3c(C)cc(N4CCOCC4)nc3cc2)=S)CCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
455.67
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.662
Distribution Coefficient, logD
1.944
Water Solubility, LogSw
-4.29
Polar Surface Area
43.174
Acid Dissociation Constant (pKa)
13.50
Base Dissociation Constant (pKb)
10.12
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
60.00
C340-0346 in Drug Discovery
Included in Screening Libraries
PI3K-Targeted Library (17255 compounds)
MCE-18 Trends in Medicinal Chemistry (51288 compounds)
Included in 1.7M Stock Database
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with C340-0346 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)