Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-
TL;DR: Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- (CAS 681852-18-6) is a chemical compound with molecular formula C21H31NO2S and molecular weight 361.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantylmethyl)-4-tert-butylbenzenesulfonamide
Also Known As: Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-, N-(1-adamantylmethyl)-4-tert-butylbenzenesulfonamide, (adamantanylmethyl){[4-(tert-butyl)phenyl]sulfonyl}amine, A2938/0123685, N-[(adamantan-1-yl)methyl]-4-tert-butylbenzene-1-sulfonamide
| Molecular Formula | C21H31NO2S |
|---|---|
| Molecular Weight | 361.21 g/mol |
| LogP | 4.4788 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.20755 |
| Heavy Atoms | 25 |
| Complexity | 707.81165 |
Chemical Identifiers
| CAS Number | 681852-18-6 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC23CC4CC(C2)CC(C4)C3 |
Product Overview
Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- (CAS 681852-18-6), with molecular formula C21H31NO2S and molecular weight 361.21 g/mol. IUPAC: N-(1-adamantylmethyl)-4-tert-butylbenzenesulfonamide.
Chemical Property Profile of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-
Property Insights of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-
The XLogP value of 4.4788 indicates that Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.17 Ų, Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-?
The CAS number of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- is 681852-18-6.
What is the molecular formula of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-?
The molecular formula of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- is C21H31NO2S.
What is the molecular weight of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-?
The molecular weight of Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- is 361.21 g/mol.
Where can I buy Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-?
You can request a quote for Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonamide, N-(adamantan-1-yl)methyl-4-tert-butyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.