G804-0862 Screening compound: 7-[(2-chloro-4,6-dimethoxyphenyl)amino]-6-(2,5-dimethoxyphenyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of ChemDiv screening compound G804-0862
7-[(2-chloro-4,6-dimethoxyphenyl)amino]-6-(2,5-dimethoxyphenyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one
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
G804-0862
Molecular Formula
C23H22ClN3O5 (C23 H22 ClN3 O5)
Compound Name
7-[(2-chloro-4,6-dimethoxyphenyl)amino]-6-(2,5-dimethoxyphenyl)-5H,6H,7H-pyrrolo[3,4-b]pyridin-5-one
IUPAC name
7-[(2-chloro-46-dimethoxyphenyl)amino]-6-(25-dimethoxyphenyl)-5H6H7H-pyrrolo[34-b]pyridin-5-one
SMILES
COc(cc1)cc(N(C(c2ncccc22)Nc(c(OC)cc(OC)c3)c3Cl)C2=O)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
455.9
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
3.769
Distribution Coefficient, logD
3.769
Water Solubility, LogSw
-4.17
Polar Surface Area
62.951
Acid Dissociation Constant (pKa)
13.98
Base Dissociation Constant (pKb)
0.19
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
21.70
G804-0862 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Allosteric Kinases Inhibitors Library (23117 compounds)
Anticancer Library (62698 compounds)
Serine Proteases Inhibitors Library (32732 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Female
- Congenital
- Skin
- Cancer
- Infections
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Cardiovascular
- Skin
- Metabolic
- Immune system
- Kinases
- Proteases
- Agro
References: we are preparing a list of scientific research reports with G804-0862 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)