RefChem:322186
TL;DR: RefChem:322186 (CAS 72593-31-8) is a chemical compound with molecular formula C24H28N4O3S and molecular weight 452.1882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methylsulfonyl-N-[2-(3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraen-6-yl)ethyl]benzamide
Also Known As: Benzamide, N-(2-(3,4,6,7,12,12a-hexahydropyrazino(1',2':1,6)pyrido(3,4-b)indol-2(1H)-yl)ethyl)-4-(methylsulfonyl)-, N-[2-(3,4,6,7,12,12a-Hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl)ethyl]-4-(methanesulfonyl)benzamide, BRN 4603856
Technical Specifications
| Molecular Formula | C24H28N4O3S |
| Molecular Weight | 452.1882 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 93.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 452.1882 Da |
| Heavy Atoms | 32 |
| Complexity | 777.0 |
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCCN2CCN3CC4=C(CC3C2)C5=CC=CC=C5N4 |
| InChIKey | DSFIUTPCZYDNCA-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:322186
Property Insights of RefChem:322186
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:322186. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322186. Following Lipinski's Rule of Five, RefChem:322186 has 2 hydrogen bond donor(s) and 5 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:322186?
The CAS number of RefChem:322186 is 72593-31-8.
What is the molecular formula of RefChem:322186?
The molecular formula of RefChem:322186 is C24H28N4O3S.
What is the molecular weight of RefChem:322186?
The molecular weight of RefChem:322186 is 452.1882 g/mol.
Where can I buy RefChem:322186?
You can request a quote for RefChem:322186 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:322186?
Yes, CoreyChem provides custom synthesis services for RefChem:322186 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.