N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide
TL;DR: N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide (CAS 418794-45-3) is a chemical compound with molecular formula C21H29NO3S and molecular weight 375.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide
Also Known As: BAS 01053283, N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide, N-(Adamantane-1-carbonyl)-4-tert-butyl-benzenesulfonamide, N-(1-adamantylcarbonyl)-4-tert-butylbenzenesulfonamide, N-(4-TERT-BUTYLBENZENESULFONYL)ADAMANTANE-1-CARBOXAMIDE
| Molecular Formula | C21H29NO3S |
|---|---|
| Molecular Weight | 375.19 g/mol |
| LogP | 4.0054 |
| Topological Polar Surface Area | 63.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.18683 |
| Heavy Atoms | 26 |
| Complexity | 782.52313 |
Chemical Identifiers
| CAS Number | 418794-45-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC(=O)C23CC4CC(C2)CC(C4)C3 |
Product Overview
N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide (CAS 418794-45-3), with molecular formula C21H29NO3S and molecular weight 375.19 g/mol. IUPAC: N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide.
Chemical Property Profile of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide
Property Insights of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide
The XLogP value of 4.0054 indicates that N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.24 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide. Following Lipinski's Rule of Five, N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide has 1 hydrogen bond donor(s) and 3 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 N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide?
The CAS number of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide is 418794-45-3.
What is the molecular formula of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide?
The molecular formula of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide is C21H29NO3S.
What is the molecular weight of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide?
The molecular weight of N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide is 375.19 g/mol.
Where can I buy N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide?
You can request a quote for N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-tert-butylphenyl)sulfonyladamantane-1-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.