TL;DR: Boc-QAR-AMC (CAS 113866-20-9) is a chemical compound with molecular formula C29H42N8O8 and molecular weight 630.31256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[5-amino-1-[[1-[[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]carbamate
Also Known As: Boc-QAR-AMC, Boc-Gln-Ala-Arg-Mca, Boc-Gln-Ala-Arg-AMC, AMC123, Boc-Gln-Ala-Arg-7-Amino-4-Methylcoumarin
| Molecular Formula | C29H42N8O8 |
| Molecular Weight | 630.31256 g/mol |
| XLogP | -0.7 |
| Topological Polar Surface Area (TPSA) | 259.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 16 |
| Exact Mass | 630.31256 Da |
| Heavy Atoms | 45 |
| Complexity | 1180.0 |
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(C)NC(=O)C(CCC(=O)N)NC(=O)OC(C)(C)C |
| InChIKey | LQSLBVXESNRILG-UHFFFAOYSA-N |
The XLogP value of -0.7 indicates that Boc-QAR-AMC is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 259.0 Ų indicates high polarity, suggesting Boc-QAR-AMC may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Boc-QAR-AMC has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Boc-QAR-AMC is 113866-20-9.
The molecular formula of Boc-QAR-AMC is C29H42N8O8.
The molecular weight of Boc-QAR-AMC is 630.31256 g/mol.
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