C878-0935 Screening compound: 4-{4-[({3-benzyl-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzoyl}morpholine
Chemical Structure Depiction of ChemDiv screening compound C878-0935
4-{4-[({3-benzyl-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzoyl}morpholine
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
C878-0935
Molecular Formula
C25H24N4O2S (C25 H24 N4 O2 S)
Compound Name
4-{4-[({3-benzyl-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzoyl}morpholine
IUPAC name
4-{4-[({3-benzyl-3H-imidazo[45-c]pyridin-2-yl}sulfanyl)methyl]benzoyl}morpholine
SMILES
O=C(c1ccc(CSc2nc(ccnc3)c3n2Cc2ccccc2)cc1)N1CCOCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
HOOCCOOH
Molecular Weight
444.56
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.317
Distribution Coefficient, logD
3.314
Water Solubility, LogSw
-3.22
Polar Surface Area
44.552
Acid Dissociation Constant (pKa)
22.95
Base Dissociation Constant (pKb)
5.26
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
24.00
C878-0935 in Drug Discovery
Included in Screening Libraries
Nucleic Acid Ligands (8311 compounds)
PI3K-Targeted Library (17255 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Male
- Female
- Hemic and lymphatic
- Skin
- Kinases
References: we are preparing a list of scientific research reports with C878-0935 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)