![N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide structure](/static/products/839/839701-70-1.png)
N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
TL;DR: N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide (CAS 839701-70-1) is a chemical compound with molecular formula C19H16N4O5S and molecular weight 412.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Also Known As: N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide, 5-Methyl-3-phenyl-isoxazole-4-carboxylic acid [N'-(2,4-dihydroxy-benzoyl)-hydrazinocarbothioyl]-amide, N-(2-(2,4-dihydroxybenzoyl)hydrazinecarbonothioyl)-5-methyl-3-phenylisoxazole-4-carboxamide, N-[[(2,4-dihydroxybenzoyl)amino]thiocarbamoyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide, N-({2-[(2,4-dihydroxyphenyl)carbonyl]hydrazinyl}carbonothioyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
| Molecular Formula | C19H16N4O5S |
|---|---|
| Molecular Weight | 412.08 g/mol |
| LogP | 2.01052 |
| Topological Polar Surface Area | 136.72 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 412.08414 |
| Heavy Atoms | 29 |
| Complexity | 1081.4585 |
Chemical Identifiers
| CAS Number | 839701-70-1 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=S)NNC(=O)C3=C(C=C(C=C3)O)O |
Product Overview
N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide (CAS 839701-70-1), with molecular formula C19H16N4O5S and molecular weight 412.08 g/mol. IUPAC: N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Property Insights of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
The XLogP value of 2.01052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide. The TPSA of 136.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide. Following Lipinski's Rule of Five, N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide has 5 hydrogen bond donor(s) and 7 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-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
The CAS number of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide is 839701-70-1.
What is the molecular formula of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
The molecular formula of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide is C19H16N4O5S.
What is the molecular weight of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
The molecular weight of N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide is 412.08 g/mol.
Where can I buy N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
You can request a quote for N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[(2,4-dihydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.