TL;DR: Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- (CAS 120466-20-8) is a chemical compound with molecular formula C25H37BrN2O2S and molecular weight 508.1759 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-bromophenyl)sulfonyl-7-(cyclohexylmethyl)spiro[3,7-diazabicyclo[3.3.1]nonane-9,1'-cyclohexane]
Also Known As: Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-, 3-(3-Bromobenzene-1-sulfonyl)-7-(cyclohexylmethyl)-3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclohexane], 3-(3-bromophenyl)sulfonyl-7-(cyclohexylmethyl)spiro[3,7-diazabicyclo[3.3.1]nonane-9,1'-cyclohexane]
| Molecular Formula | C25H37BrN2O2S |
| Molecular Weight | 508.1759 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 49.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.1759 Da |
| Heavy Atoms | 31 |
| Complexity | 694.0 |
| SMILES | C1CCC(CC1)CN2CC3CN(CC(C2)C34CCCCC4)S(=O)(=O)C5=CC(=CC=C5)Br |
| InChIKey | DMQXYOYTOUHHPS-UHFFFAOYSA-N |
The XLogP value of 6.8 indicates that Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.0 Ų, Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- is 120466-20-8.
The molecular formula of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- is C25H37BrN2O2S.
The molecular weight of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- is 508.1759 g/mol.
You can request a quote for Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 120466-20-8. Our professional technical team will respond with pricing and lead time.