N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide
TL;DR: N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide (CAS 690970-30-0) is a chemical compound with molecular formula C21H21N3O2S2 and molecular weight 411.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide
Also Known As: N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide, N-{[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl}-3-propoxybenzamide
| Molecular Formula | C21H21N3O2S2 |
|---|---|
| Molecular Weight | 411.11 g/mol |
| LogP | 5.03412 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.1075 |
| Heavy Atoms | 28 |
| Complexity | 967.7919 |
Chemical Identifiers
| CAS Number | 690970-30-0 |
|---|---|
| SMILES | CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)C |
Product Overview
N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide (CAS 690970-30-0), with molecular formula C21H21N3O2S2 and molecular weight 411.11 g/mol. IUPAC: N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide.
Chemical Property Profile of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide
Property Insights of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide
The XLogP value of 5.03412 indicates that N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide. Following Lipinski's Rule of Five, N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide?
The CAS number of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide is 690970-30-0.
What is the molecular formula of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide?
The molecular formula of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide is C21H21N3O2S2.
What is the molecular weight of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide?
The molecular weight of N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide is 411.11 g/mol.
Where can I buy N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide?
You can request a quote for N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-3-propoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.