RefChem:1056400
TL;DR: RefChem:1056400 (CAS 114967-70-3) is a chemical compound with molecular formula C26H45N3O2 and molecular weight 431.35117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-(4-methylpiperazin-1-yl)acetamide
Also Known As: 3-beta-Hydroxy-17-beta-((N-methylpiperazino)acetylamino)-5-alpha-androstane, 1-Piperazineacetamide, N-(3-hydroxyandrostan-17-yl)-4-methyl-, (3-beta,5-alpha,17-beta)-, N-(3-Hydroxyandrostan-17-yl)-2-(4-methylpiperazin-1-yl)ethanimidic acid, N-[(3S,5S,10S,13S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-(4-methylpiperazin-1-yl)acetamide, N-[(8xi,9xi,14xi)-3beta-Hydroxy-5alpha-androstan-17beta-yl](4-methylpiperazin-1-yl)ethanimidic acid
Technical Specifications
| Molecular Formula | C26H45N3O2 |
| Molecular Weight | 431.35117 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 431.35117 Da |
| Heavy Atoms | 31 |
| Complexity | 678.0 |
| SMILES | C[C@]12CC[C@@H](C[C@@H]1CCC3C2CC[C@]4(C3CC[C@@H]4NC(=O)CN5CCN(CC5)C)C)O |
| InChIKey | QFBNAGXBPHDTHX-CUTQXZKCSA-N |
Chemical Property Profile of RefChem:1056400
Property Insights of RefChem:1056400
The XLogP value of 4.0 indicates that RefChem:1056400 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, RefChem:1056400 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1056400 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1056400?
The CAS number of RefChem:1056400 is 114967-70-3.
What is the molecular formula of RefChem:1056400?
The molecular formula of RefChem:1056400 is C26H45N3O2.
What is the molecular weight of RefChem:1056400?
The molecular weight of RefChem:1056400 is 431.35117 g/mol.
Where can I buy RefChem:1056400?
You can request a quote for RefChem:1056400 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1056400?
Yes, CoreyChem provides custom synthesis services for RefChem:1056400 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.