TL;DR: Bpdpve (CAS 110771-17-0) is a chemical compound with molecular formula C29H37N3O6 and molecular weight 523.26825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-methyl-2-[[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]-3-phenylprop-2-enoyl]amino]butanoate
Also Known As: Bpdpve, Boc-L-phe-dehydro-phe-L-val-och3, Butyloxycarbonyl-phenylalanyl-dehydrophenylalanyl-valine methyl ester, L-Valine,N-[(1,1-dimethylethoxy)carbonyl]-L-phenylalanyl-(aZ)-a,b-didehydrophenylalanyl-, methylester (9CI), N-((Z)-alpha,beta-didehydro-N-(N-((1,1-dimethylethoxy)carbonyl)-L-phenylalanyl)phenylalanyl)-L-valine methyl ester
| Molecular Formula | C29H37N3O6 |
| Molecular Weight | 523.26825 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 523.26825 Da |
| Heavy Atoms | 38 |
| Complexity | 836.0 |
| SMILES | CC(C)C(C(=O)OC)NC(=O)C(=CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C |
| InChIKey | DYCVSWARECFBGS-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that Bpdpve is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bpdpve. Following Lipinski's Rule of Five, Bpdpve has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Bpdpve is 110771-17-0.
The molecular formula of Bpdpve is C29H37N3O6.
The molecular weight of Bpdpve is 523.26825 g/mol.
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