1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea
TL;DR: 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea (CAS 16893-11-1) is a chemical compound with molecular formula C16H19N3OS2 and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)carbamothioyl]benzamide
Also Known As: BAS 00491994, 1-BENZOYL-3-(5-TERT-BUTYL-4-METHYL-1,3-THIAZOL-2-YL)THIOUREA, AB00089898-01, BRD-K12300101-001-01-1, n-[(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)carbamothioyl]benzamide
| Molecular Formula | C16H19N3OS2 |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.09695 |
| Heavy Atoms | 22 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 16893-11-1 |
|---|---|
| SMILES | CC1=C(SC(=N1)NC(=S)NC(=O)C2=CC=CC=C2)C(C)(C)C |
| InChIKey | ZHRRVEKEOBJEBX-UHFFFAOYSA-N |
Product Overview
1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea (CAS 16893-11-1), with molecular formula C16H19N3OS2 and molecular weight 333.10 g/mol. IUPAC: N-[(5-tert-butyl-4-methyl-1,3-thiazol-2-yl)carbamothioyl]benzamide.
Chemical Property Profile of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea
Property Insights of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea
The XLogP value of 5.0 indicates that 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea. Following Lipinski's Rule of Five, 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea has 2 hydrogen bond donor(s) and 4 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 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea?
The CAS number of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea is 16893-11-1.
What is the molecular formula of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea?
The molecular formula of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea is C16H19N3OS2.
What is the molecular weight of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea?
The molecular weight of 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea is 333.10 g/mol.
Where can I buy 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea?
You can request a quote for 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzoyl-3-(5-tert-butyl-4-methyl-1,3-thiazol-2-YL)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.