![3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide structure](/static/products/688/688012-43-3.png)
3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide
TL;DR: 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide (CAS 688012-43-3) is a chemical compound with molecular formula C24H20BrN3O3S and molecular weight 509.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-4-methoxybenzamide
Also Known As: 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide, 3-bromo-N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-4-methoxybenzamide, 3-bromo-N-{[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-methoxybenzamide, N-({[4-(5,7-dimethylbenzoxazol-2-yl)phenyl]amino}thioxomethyl)(3-bromo-4-metho xyphenyl)carboxamide
| Molecular Formula | C24H20BrN3O3S |
|---|---|
| Molecular Weight | 509.04 g/mol |
| LogP | 6.00954 |
| Topological Polar Surface Area | 76.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 509.0409 |
| Heavy Atoms | 32 |
| Complexity | 1332.5796 |
Chemical Identifiers
| CAS Number | 688012-43-3 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)Br)C |
Product Overview
3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide (CAS 688012-43-3), with molecular formula C24H20BrN3O3S and molecular weight 509.04 g/mol. IUPAC: 3-bromo-N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-4-methoxybenzamide.
Chemical Property Profile of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide
Property Insights of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide
The XLogP value of 6.00954 indicates that 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide. Following Lipinski's Rule of Five, 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide 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 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
The CAS number of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide is 688012-43-3.
What is the molecular formula of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
The molecular formula of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide is C24H20BrN3O3S.
What is the molecular weight of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
The molecular weight of 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide is 509.04 g/mol.
Where can I buy 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
You can request a quote for 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-((4-(5,7-dimethylbenzo[d]oxazol-2-yl)phenyl)carbamothioyl)-4-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.