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Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- structure
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Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-

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]

CAS Number
120466-20-8
Molecular Formula
C25H37BrN2O2S
Molecular Weight
508.1759 g/mol
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Technical Specifications

Molecular FormulaC25H37BrN2O2S
Molecular Weight508.1759 g/mol
XLogP6.8
Topological Polar Surface Area (TPSA)49.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass508.1759 Da
Heavy Atoms31
Complexity694.0
SMILESC1CCC(CC1)CN2CC3CN(CC(C2)C34CCCCC4)S(=O)(=O)C5=CC(=CC=C5)Br
InChIKeyDMQXYOYTOUHHPS-UHFFFAOYSA-N

Chemical Property Profile of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-

XLogP
6.8
TPSA (Topological Polar Surface Area)
49.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
31
Complexity
694.0
Exact Mass
508.1759
Monoisotopic Mass
508.1759
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-

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.

Frequently Asked Questions

What is the CAS number of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-?

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.

What is the molecular formula of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-?

The molecular formula of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)- is C25H37BrN2O2S.

What is the molecular weight of Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-?

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.

Where can I buy Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-?

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.

Does CoreyChem offer custom synthesis for Spiro(cyclohexane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3'-((4-bromophenyl)sulfonyl)-7'-(cyclohexylmethyl)-?

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.

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