RefChem:907114
TL;DR: RefChem:907114 (CAS 130663-39-7) is a chemical compound with molecular formula C31H32N4O3 and molecular weight 508.24744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[4-(dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
1-[[4-(dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
Also Known As: EMA200, PD 123319, PD 123319 ditrifluoroacetate, KST-1B0181, 1-[[4-(dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C31H32N4O3 |
| Molecular Weight | 508.24744 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 78.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 508.24744 Da |
| Heavy Atoms | 38 |
| Complexity | 791.0 |
| SMILES | CC1=C(C=CC(=C1)CN2C=NC3=C2CC(N(C3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)O)N(C)C |
| InChIKey | YSTVFDAKLDMYCR-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:907114
Property Insights of RefChem:907114
The XLogP value of 4.4 indicates that RefChem:907114 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:907114. Following Lipinski's Rule of Five, RefChem:907114 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:907114?
The CAS number of RefChem:907114 is 130663-39-7.
What is the molecular formula of RefChem:907114?
The molecular formula of RefChem:907114 is C31H32N4O3.
What is the molecular weight of RefChem:907114?
The molecular weight of RefChem:907114 is 508.24744 g/mol.
Where can I buy RefChem:907114?
You can request a quote for RefChem:907114 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:907114?
Yes, CoreyChem provides custom synthesis services for RefChem:907114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.