4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide
TL;DR: 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide (CAS 496031-65-3) is a chemical compound with molecular formula C24H25N3OS and molecular weight 403.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-anilinophenyl)carbamothioyl]-4-tert-butylbenzamide
Also Known As: N-[(4-anilinophenyl)carbamothioyl]-4-tert-butylbenzamide, N-{[(4-anilinophenyl)amino]carbonothioyl}-4-tert-butylbenzamide, 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide, 4-tert-butyl-N-{[4-(phenylamino)phenyl]carbamothioyl}benzamide, [4-(tert-butyl)phenyl]-N-({[4-(phenylamino)phenyl]amino}thioxomethyl)carboxami de
| Molecular Formula | C24H25N3OS |
|---|---|
| Molecular Weight | 403.17 g/mol |
| LogP | 5.8545 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.17184 |
| Heavy Atoms | 29 |
| Complexity | 975.3893 |
Chemical Identifiers
| CAS Number | 496031-65-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
Product Overview
4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide (CAS 496031-65-3), with molecular formula C24H25N3OS and molecular weight 403.17 g/mol. IUPAC: N-[(4-anilinophenyl)carbamothioyl]-4-tert-butylbenzamide.
Chemical Property Profile of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide
Property Insights of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide
The XLogP value of 5.8545 indicates that 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide?
The CAS number of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide is 496031-65-3.
What is the molecular formula of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide?
The molecular formula of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide is C24H25N3OS.
What is the molecular weight of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide?
The molecular weight of 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide is 403.17 g/mol.
Where can I buy 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide?
You can request a quote for 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-Butyl-N-(4-(phenylamino)phenylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.