TL;DR: RefChem:239020 (CAS 73521-00-3) is a chemical compound with molecular formula C40H47ClN4O7 and molecular weight 730.31335 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[4-benzamido-5-(dipropylamino)-5-oxopentanoyl]amino]propyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate
Also Known As: 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, 3-((4-(benzoylamino)-5-(dipropylamino)-1,5-dioxopentyl)amino)propyl ester, (+-)-, 3-[[4-benzamido-5-(dipropylamino)-5-oxopentanoyl]amino]propyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate, N-[5-{[3-({[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl}oxy)propyl]imino}-1-(dipropylamino)-5-hydroxy-1-oxopentan-2-yl]benzenecarboximidic acid, BRN 0471017
| Molecular Formula | C40H47ClN4O7 |
| Molecular Weight | 730.31335 g/mol |
| XLogP | 6.9 |
| Topological Polar Surface Area (TPSA) | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 19 |
| Exact Mass | 730.31335 Da |
| Heavy Atoms | 52 |
| Complexity | 1170.0 |
| SMILES | CCCN(CCC)C(=O)C(CCC(=O)NCCCOC(=O)CC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)Cl)C)NC(=O)C4=CC=CC=C4 |
| InChIKey | CBHVJCYCLIGOFM-UHFFFAOYSA-N |
The XLogP value of 6.9 indicates that RefChem:239020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:239020. Following Lipinski's Rule of Five, RefChem:239020 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of RefChem:239020 is 73521-00-3.
The molecular formula of RefChem:239020 is C40H47ClN4O7.
The molecular weight of RefChem:239020 is 730.31335 g/mol.
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