TL;DR: Buxafuranamide (CAS 123871-27-2) is a chemical compound with molecular formula C35H48N2O5 and molecular weight 576.3563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[16-benzamido-7-[1-(dimethylamino)ethyl]-13-hydroxy-4,8,17-trimethyl-19-oxapentacyclo[11.6.1.03,11.04,8.017,20]icosa-10,14-dien-6-yl] acetate
Also Known As: Buxafuranamide, (+)-buxafuranamide, ( )-Buxafuranamide, [16-Benzamido-7-[1-(dimethylamino)ethyl]-13-hydroxy-4,8,17-trimethyl-19-oxapentacyclo[11.6.1.03,11.04,8.017,20]icosa-10,14-dien-6-yl] acetate, Benzamide, N-((3beta,4alpha,5alpha,6alpha,16alpha,20S)-16-(acetyloxy)-20-(dimethylamino)-4,5,5',6-tetrahydro-10-hydroxy-4,14-dimethyl-B(9a)-homo-19-norpregna-1,5,9(11)-trieno(6,5,4-bc)furan-3-yl)-
| Molecular Formula | C35H48N2O5 |
| Molecular Weight | 576.3563 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 88.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 576.3563 Da |
| Heavy Atoms | 42 |
| Complexity | 1160.0 |
| SMILES | CC(C1C(CC2(C1(CC=C3C2CC4C5C(CO4)(C(C=CC5(C3)O)NC(=O)C6=CC=CC=C6)C)C)C)OC(=O)C)N(C)C |
| InChIKey | VCPJZJYGJJULKC-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that Buxafuranamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Buxafuranamide. Following Lipinski's Rule of Five, Buxafuranamide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Buxafuranamide is 123871-27-2.
The molecular formula of Buxafuranamide is C35H48N2O5.
The molecular weight of Buxafuranamide is 576.3563 g/mol.
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