Acetyldipeptide B2
TL;DR: Acetyldipeptide B2 (CAS 88169-58-8) is a chemical compound with molecular formula C16H24ClN7O2S2 and molecular weight 445.11215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(2-acetamidoethyl)-1,3-thiazol-4-yl]-N-[4-(diaminomethylideneamino)butyl]-1,3-thiazole-4-carboxamide;hydrochloride
Also Known As: Acetyldipeptide B2, 2-[2-(2-acetamidoethyl)-1,3-thiazol-4-yl]-N-[4-(diaminomethylideneamino)butyl]-1,3-thiazole-4-carboxamide;hydrochloride, (2,4'-Bithiazole)-4-carboxamide, 2'-(2-(acetylamino)ethyl)-N-(4-((aminoiminomethyl)amino)butyl)-, monohydrochloride, 2'-(2-Acetamidoethyl)-N-{4-[(diaminomethylidene)amino]butyl}[2,4'-bi-1,3-thiazole]-4-carboxamide--hydrogen chloride (1/1), 2-[2-(2-acetamidoethyl)-1,3-thiazol-4-yl]-N-[4-(diaminomethylideneamino)butyl]-1,3-thiazole-4-carboxamide hydrochloride
Technical Specifications
| Molecular Formula | C16H24ClN7O2S2 |
| Molecular Weight | 445.11215 g/mol |
| XLogP | 1.1504 |
| Topological Polar Surface Area (TPSA) | 205.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 445.11215 Da |
| Heavy Atoms | 28 |
| Complexity | 531.0 |
| SMILES | CC(=O)NCCC1=NC(=CS1)C2=NC(=CS2)C(=O)NCCCCN=C(N)N.Cl |
| InChIKey | OBCGPRZWYQUASR-UHFFFAOYSA-N |
Chemical Property Profile of Acetyldipeptide B2
Property Insights of Acetyldipeptide B2
The XLogP value of 1.1504 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetyldipeptide B2. The TPSA of 205.0 Ų indicates high polarity, suggesting Acetyldipeptide B2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetyldipeptide B2 has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetyldipeptide B2?
The CAS number of Acetyldipeptide B2 is 88169-58-8.
What is the molecular formula of Acetyldipeptide B2?
The molecular formula of Acetyldipeptide B2 is C16H24ClN7O2S2.
What is the molecular weight of Acetyldipeptide B2?
The molecular weight of Acetyldipeptide B2 is 445.11215 g/mol.
Where can I buy Acetyldipeptide B2?
You can request a quote for Acetyldipeptide B2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetyldipeptide B2?
Yes, CoreyChem provides custom synthesis services for Acetyldipeptide B2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.