TL;DR: RG 13647 (CAS 145543-03-9) is a chemical compound with molecular formula C30H27N3O5 and molecular weight 509.19507 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
Also Known As: RG 13647, 1H-Imidazo(4,5-c)pyridine-6-carboxylic acid, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-5-(diphenylacetyl)-4,5,6,7-tetrahydro-, 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid, 1-(1,4-Benzodioxan-2-methyl)-5-diphenylacetyl-4,5,6,7-tetrahydro-1H-imidazo(4,5-c)pyridine-6-carboxylic acid, 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-5-(2,2-diphenylacetyl)-1H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-6-carboxylic acid
| Molecular Formula | C30H27N3O5 |
| Molecular Weight | 509.19507 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 93.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 509.19507 Da |
| Heavy Atoms | 38 |
| Complexity | 811.0 |
| SMILES | C1C(N(CC2=C1N(C=N2)CC3COC4=CC=CC=C4O3)C(=O)C(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)O |
| InChIKey | ICFNCUVQGPNFBW-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that RG 13647 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RG 13647. Following Lipinski's Rule of Five, RG 13647 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RG 13647 is 145543-03-9.
The molecular formula of RG 13647 is C30H27N3O5.
The molecular weight of RG 13647 is 509.19507 g/mol.
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