A3530/0149531
TL;DR: A3530/0149531 (CAS 695205-73-3) is a chemical compound with molecular formula C19H16N4O4S and molecular weight 396.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(2-hydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Also Known As: A3530/0149531, N-[[(2-hydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide, 5-Methyl-3-phenyl-isoxazole-4-carboxylic acid [N'-(2-hydroxy-benzoyl)-hydrazinocarbothioyl]-amide, 5-methyl-3-phenyl-N-[(salicyloylamino)thiocarbamoyl]isoxazole-4-carboxamide, N-(2-(2-hydroxybenzoyl)hydrazinecarbonothioyl)-5-methyl-3-phenylisoxazole-4-carboxamide
| Molecular Formula | C19H16N4O4S |
|---|---|
| Molecular Weight | 396.09 g/mol |
| LogP | 2.30492 |
| Topological Polar Surface Area | 116.49 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.08923 |
| Heavy Atoms | 28 |
| Complexity | 1033.4227 |
Chemical Identifiers
| CAS Number | 695205-73-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3O |
Product Overview
A3530/0149531 (CAS 695205-73-3), with molecular formula C19H16N4O4S and molecular weight 396.09 g/mol. IUPAC: N-[[(2-hydroxybenzoyl)amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of A3530/0149531
Property Insights of A3530/0149531
The XLogP value of 2.30492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3530/0149531. The TPSA of 116.49 Ų falls within the moderate polarity range, balancing permeability and solubility for A3530/0149531. Following Lipinski's Rule of Five, A3530/0149531 has 4 hydrogen bond donor(s) and 6 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 A3530/0149531?
The CAS number of A3530/0149531 is 695205-73-3.
What is the molecular formula of A3530/0149531?
The molecular formula of A3530/0149531 is C19H16N4O4S.
What is the molecular weight of A3530/0149531?
The molecular weight of A3530/0149531 is 396.09 g/mol.
Where can I buy A3530/0149531?
You can request a quote for A3530/0149531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3530/0149531?
Yes, KEHONG BIO provides custom synthesis services for A3530/0149531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.