Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-
TL;DR: Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- (CAS 117125-45-8) is a chemical compound with molecular formula C17H18N2OS and molecular weight 298.11398 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6,11-dihydrobenzo[c][1]benzothiepin-11-ylamino)propanamide
Also Known As: 2-(6,11-Dihydrodibenzo(b,e)thiepin-11-ylamino)propionamide, 2-((6,11-Dihydrodibenzo(b,e)thiepin-11-yl)amino)propanamide, Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-, 2-(6,11-dihydrobenzo[c][1]benzothiepin-11-ylamino)propanamide, 2-[(6,11-Dihydrodibenzo[b,e]thiepin-11-yl)amino]propanimidic acid
Technical Specifications
| Molecular Formula | C17H18N2OS |
| Molecular Weight | 298.11398 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 80.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.11398 Da |
| Heavy Atoms | 21 |
| Complexity | 376.0 |
| SMILES | CC(C(=O)N)NC1C2=CC=CC=C2CSC3=CC=CC=C13 |
| InChIKey | KECYVVXOYVPSJP-UHFFFAOYSA-N |
Chemical Property Profile of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-
Property Insights of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-. Following Lipinski's Rule of Five, Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-?
The CAS number of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- is 117125-45-8.
What is the molecular formula of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-?
The molecular formula of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- is C17H18N2OS.
What is the molecular weight of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-?
The molecular weight of Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- is 298.11398 g/mol.
Where can I buy Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-?
You can request a quote for Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)-?
Yes, CoreyChem provides custom synthesis services for Propanamide, 2-((6,11-dihydrodibenzo(b,e)thiepin-11-yl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.