1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone
TL;DR: 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone (CAS 1022004-08-5) is a chemical compound with molecular formula C10H20N2O3S and molecular weight 248.11946 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone
Also Known As: 1-(4-propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone, 1-[4-(propane-2-sulfonyl)[1,4]diazepan-1-yl]ethanone
Technical Specifications
| Molecular Formula | C10H20N2O3S |
| Molecular Weight | 248.11946 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.11946 Da |
| Heavy Atoms | 16 |
| Complexity | 346.0 |
| SMILES | CC(C)S(=O)(=O)N1CCCN(CC1)C(=O)C |
| InChIKey | UIDKLQJHIVGMOB-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone
Property Insights of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone
The XLogP value of -0.1 indicates that 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone. Following Lipinski's Rule of Five, 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone has 0 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 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone?
The CAS number of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone is 1022004-08-5.
What is the molecular formula of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone?
The molecular formula of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone is C10H20N2O3S.
What is the molecular weight of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone?
The molecular weight of 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone is 248.11946 g/mol.
Where can I buy 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone?
You can request a quote for 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(4-Propan-2-ylsulfonyl-1,4-diazepan-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.